Vitas-M small molecule compound

ethyl 2-{[(2E)-2-cyano-3-(2,4-dichlorophenyl)prop-2-enoyl]amino}-4-phenylthiophene-3-carboxylate

Catalog ID
STK739770
SMILES CCOC(=O)c1c(scc1c1ccccc1)NC(=O)/C(=C/c1ccc(cc1Cl)Cl)/C#N

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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 C23H16Cl2N2O3S MW 471.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16Cl2N2O3S/c1-2-30-23(29)20-18(14-6-4-3-5-7-14)13-31-22(20)27-21(28)16(12-26)10-15-8-9-17(24)11-19(15)25/h3-11,13H,2H2,1H3,(H,27,28)/b16-10+
InChIKey
SCRSBUQUXRIKQQ-MHWRWJLKSA-N
Synonyms
327075-51-4
(E)ethyl2(2cyano3(24dichlorophenyl)acrylamido)4phenylthiophene3carboxylate
327075514
CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(=CC3=C(C=C(C=C3)Cl)Cl)C#N
CCOC(=O)c1c(scc1c1ccccc1)NC(=O)C(=Cc1ccc(cc1Cl)Cl)C#N
ethyl2(((2E)2cyano3(24dichlorophenyl)prop2enoyl)amino)4phenylthiophene3carboxylate
ETHYL2(((E)2CYANO3(24DICHLOROPHENYL)PROP2ENOYL)AMINO)4PHENYLTHIOPHENE3CARBOXYLATE
ETHYL2((2E)3(24DICHLOROPHENYL)2CYANOPROP2ENOYLAMINO)4PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC23H16Cl2N2O3Sc123023(29)2018(146435714)133122(20)2721(28)16(1226)10158917(24)1119(15)25h31113H2H21H3(H2728)b1610+
MFCD01953208
ZINC000002286323
ZINC02286323
ZINC2286323

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Available files

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