Vitas-M small molecule compound

N-[(1Z)-1-{1-cyano-2-oxo-2-[(1-phenylethyl)amino]ethylidene}-1H-isoindol-3-yl]thiophene-2-carboxamide

Catalog ID
STK829197
SMILES N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1cccs1)/C(=O)NC(c1ccccc1)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C24H18N4O2S MW 426.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18N4O2S/c1-15(16-8-3-2-4-9-16)26-23(29)19(14-25)21-17-10-5-6-11-18(17)22(27-21)28-24(30)20-12-7-13-31-20/h2-13,15H,1H3,(H,26,29)(H,27,28,30)/b21-19-
InChIKey
KCEQPEWYNYOTEL-VZCXRCSSSA-N
Synonyms
1164452-52-1
(Z)N(1(1cyano2oxo2((1phenylethyl)amino)ethylidene)1Hisoindol3yl)thiophene2carboxamide
1164452521
CC(C1=CC=CC=C1)NC(=O)C(=C2C3=CC=CC=C3C(=N2)NC(=O)C4=CC=CS4)C#N
InChI=1SC24H18N4O2Sc115(168324916)2623(29)19(1425)211710561118(17)22(2721)2824(30)20127133120h21315H1H3(H2629)(H272830)b2119
MFCD06599424
N#CC(=C1N=C(c2c1cccc2)NC(=O)c1cccs1)C(=O)NC(c1ccccc1)C
N((1Z)1(1cyano2oxo2((1phenylethyl)amino)ethylidene)1Hisoindol3yl)thiophene2carboxamide
N((3Z)3(1CYANO2OXO2(1PHENYLETHYLAMINO)ETHYLIDENE)ISOINDOL1YL)THIOPHENE2CARBOXAMIDE
THIOPHENE2CARBOXYLICACID(3(1CYANO1(1PHENYLETHYLCARBAMOYL)METH(Z)YLIDENE)3HISOINDOL1YL)AMIDE
ZINC000002218774
ZINC000002218778

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.