ethyl 1-benzyl-6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate



Compound number:
MolPort-004-948-103
IUPAC:
ethyl 1-benzyl-6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate
IUPAC traditional:
ethyl 1-benzyl-6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-2-[(phenylsulfanyl)methyl]indole-3-carboxylate
SMILES:
CCOC(=O)c1c(CSc2ccccc2)n(Cc2ccccc2)c2cc(Br)c(O)c(CN(C)C)c12
InChI key:
QGBWGFZKHSJGAS-UHFFFAOYSA-N
Molecular formula:
C28H29BrN2O3S
Molecular weight: 553.52
Solubility: not available

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Supplier Catalogue Data


Catalog: Screening compound Ships out: 5 business days Purity: 92 - 98%
Last updated: this month In warehouse: 169.00 mg
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3 micromol May 19, 2021 40.00 USD
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10 micromol May 19, 2021 75.00 USD
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Catalog: Screening compound Ships out: 2 business days Purity: n/a
Last updated: this month In warehouse: 20.00 mg
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2 micromol May 14, 2021 99.00 USD
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5 micromol May 14, 2021 155.00 USD
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More Information

Compound Identifiers
Compound number: MolPort-004-948-103

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000002596173
ethyl 1-benzyl-6-bromo-4-((dimethylamino)methyl)-5-hydroxy-2-((phenylthio)methyl)-1H-indole-3-carboxylate
ethyl 1-benzyl-6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate
ethyl 1-benzyl-6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-2-[(phenylthio)methyl]-1H-indole-3-carboxylate hydrochloride
ethyl 4-[(dimethylamino)methyl]-6-bromo-5-hydroxy-1-benzyl-2-(phenylthiomethyl )indole-3-carboxylate

InChI
InChI: 1S/C28H29BrN2O3S/c1-4-34-28(33)26-24(18-35-20-13-9-6-10-14-20)31(16-19-11-7-5-8-12-19)23-15-22(29)27(32)21(25(23)26)17-30(2)3/h5-15,32H,4,16-18H2,1-3H3
InChI key: QGBWGFZKHSJGAS-UHFFFAOYSA-N

Calculated Properties
Molecular formula: C28H29BrN2O3S
Molecular weight: 553.52

Other

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