Vitas-M small molecule compound
(2E)-3-{[4-chloro-2-(phenylcarbonyl)phenyl]amino}-2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Catalog ID
STK536440
SMILES CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1C(=O)c1ccccc1)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 C27H20ClN3O2S MW 485.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20ClN3O2S/c1-2-33-22-11-8-18(9-12-22)25-17-34-27(31-25)20(15-29)16-30-24-13-10-21(28)14-23(24)26(32)19-6-4-3-5-7-19/h3-14,16-17,30H,2H2,1H3/b20-16+InChIKey
MICJTOCKBJVBIM-CAPFRKAQSA-NSynonyms
(2E)3((4chloro2(phenylcarbonyl)phenyl)amino)2(4(4ethoxyphenyl)13thiazol2yl)prop2enenitrile
(E)3((2benzoyl4chlorophenyl)amino)2(4(4ethoxyphenyl)thiazol2yl)acrylonitrile
(E)3(2BENZOYL4CHLOROANILINO)2(4(4ETHOXYPHENYL)13THIAZOL2YL)PROP2ENENITRILE
CCOC1=CC=C(C=C1)C2=CSC(=N2)C(=CNC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4)C#N
CCOc1ccc(cc1)c1csc(n1)C(=CNc1ccc(cc1C(=O)c1ccccc1)Cl)C#N
InChI=1SC27H20ClN3O2Sc12332211818(91222)25173427(3125)20(1529)163024131021(28)1423(24)26(32)196435719h314161730H2H21H3b2016+
MFCD02983383
ZINC000001787937
ZINC01787937
ZINC1787937
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