Vitas-M small molecule compound
methyl 2-({(2E)-2-cyano-3-[4-(propan-2-yl)phenyl]prop-2-enoyl}amino)-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK548586
SMILES N#C/C(=C\c1ccc(cc1)C(C)C)/C(=O)Nc1sc(c(c1C(=O)OC)C)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 C21H22N2O3S MW 382.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3S/c1-12(2)16-8-6-15(7-9-16)10-17(11-22)19(24)23-20-18(21(25)26-5)13(3)14(4)27-20/h6-10,12H,1-5H3,(H,23,24)/b17-10+InChIKey
XTYIHHVWKPESCG-LICLKQGHSA-NSynonyms
469876-77-5(E)methyl2(2cyano3(4isopropylphenyl)acrylamido)45dimethylthiophene3carboxylate
469876775
CC1=C(SC(=C1C(=O)OC)NC(=O)C(=CC2=CC=C(C=C2)C(C)C)C#N)C
InChI=1SC21H22N2O3Sc112(2)168615(7916)1017(1122)19(24)232018(21(25)265)13(3)14(4)2720h61012H15H3(H2324)b1710+
methyl2(((2E)2cyano3(4(propan2yl)phenyl)prop2enoyl)amino)45dimethylthiophene3carboxylate
methyl2(((E)2cyano3(4propan2ylphenyl)prop2enoyl)amino)45dimethylthiophene3carboxylate
METHYL2((2E)2CYANO3(4(METHYLETHYL)PHENYL)PROP2ENOYLAMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
MFCD02370901
N#CC(=Cc1ccc(cc1)C(C)C)C(=O)Nc1sc(c(c1C(=O)OC)C)C
ZINC000000949268
ZINC00949268
ZINC949268
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