N-[2-(diethylamino)ethyl]-2,4-dimethyl-5-{[(3Z)-2-oxo-5-(2-phenyl-1,3-thiazol-4-yl)-2,3-dihydro-1H-indol-3-ylidene]methyl}-1H-pyrrole-3-carboxamide



Compound number:
MolPort-046-033-606
CAS number: 1129403-56-0
IUPAC:
N-[2-(diethylamino)ethyl]-2,4-dimethyl-5-{[(3Z)-2-oxo-5-(2-phenyl-1,3-thiazol-4-yl)-2,3-dihydro-1H-indol-3-ylidene]methyl}-1H-pyrrole-3-carboxamide
IUPAC traditional:
N-[2-(diethylamino)ethyl]-2,4-dimethyl-5-{[(3Z)-2-oxo-5-(2-phenyl-1,3-thiazol-4-yl)-1H-indol-3-ylidene]methyl}-1H-pyrrole-3-carboxamide
SMILES:
CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(cc23)-c2csc(n2)-c2ccccc2)c1C
InChI key:
QDWKGEFGLQMDAM-ULJHMMPZSA-N
Molecular formula:
C31H33N5O2S
Molecular weight: 539.7
Solubility: not available


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Supplier Catalogue Data


Catalog: Screening compound Ships out: 2 business days Purity: 98.0
Last updated: 3 months ago In warehouse: Unverified
Pack size Ships out Price Qty
5 mg August 10, 2020 175.45 USD
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25 mg August 10, 2020 538.45 USD
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More Information

Compound Identifiers
Compound number: MolPort-046-033-606
CAS number: 1129403-56-0

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000059029686
Amcasertib
N-(2-(Diethylamino)ethyl)-2,4-dimethyl-5-((2-oxo-5-(2-phenylthiazol-4-yl)indolin-3-ylidene)methyl)-1H-pyrrole-3-carboxamide

InChI
InChI: 1S/C31H33N5O2S/c1-5-36(6-2)15-14-32-30(38)28-19(3)26(33-20(28)4)17-24-23-16-22(12-13-25(23)34-29(24)37)27-18-39-31(35-27)21-10-8-7-9-11-21/h7-13,16-18,33H,5-6,14-15H2,1-4H3,(H,32,38)(H,34,37)/b24-17-
InChI key: QDWKGEFGLQMDAM-ULJHMMPZSA-N

Calculated Properties
Molecular formula: C31H33N5O2S
Molecular weight: 539.7

Other

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2020 MolPort, v3.86, release date 05-08-2020 19:00 (+0200). All rights reserved.
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