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2-[(5-{[(3-chloro-4-methylphenyl)amino]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,6-dimethylphenyl)propanamide



Compound number:
MolPort-000-010-831
IUPAC:
2-[(5-{[(3-chloro-4-methylphenyl)amino]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,6-dimethylphenyl)propanamide
IUPAC traditional:
2-[(5-{[(3-chloro-4-methylphenyl)amino]methyl}-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,6-dimethylphenyl)propanamide
SMILES:
CC(Sc1nnc(CNc2ccc(C)c(Cl)c2)n1C)C(=O)Nc1c(C)cccc1C
InChI key:
GOXMJNGIOFCNOQ-UHFFFAOYSA-N
Molecular formula:
C22H26ClN5OS
Molecular weight: 443.99
Solubility: not available

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Supplier Catalogue Data


Catalog: Screening compound Ships out: 12 business days Purity: n/a
Last updated: today In warehouse: 12.90 mg
Pack size Ships out Price Qty
5 mg November 4, 2021 24.51 USD
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10 mg November 4, 2021 24.51 USD
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More Information

Compound Identifiers
Compound number: MolPort-000-010-831

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000000917284
ZINC000000917285
2-({5-(3-chloro-4-methylanilino)methyl-4-methyl-4H-,2,4-triazol-3-yl}sulfanyl)-N-(2,6-dimethylphenyl)propanamide
N-(2,6-dimethylphenyl)-2-(5-{[(3-chloro-4-methylphenyl)amino]methyl}-4-methyl( 1,2,4-triazol-3-ylthio))propanamide

InChI
InChI: 1S/C22H26ClN5OS/c1-13-9-10-17(11-18(13)23)24-12-19-26-27-22(28(19)5)30-16(4)21(29)25-20-14(2)7-6-8-15(20)3/h6-11,16,24H,12H2,1-5H3,(H,25,29)
InChI key: GOXMJNGIOFCNOQ-UHFFFAOYSA-N

Calculated Properties
Molecular formula: C22H26ClN5OS
Molecular weight: 443.99

Other

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