Vitas-M small molecule compound
methyl 3-({(2E)-3-[4-(propan-2-yl)phenyl]prop-2-enoyl}amino)thiophene-2-carboxylate
Catalog ID
STK429063
SMILES COC(=O)c1sccc1NC(=O)/C=C/c1ccc(cc1)C(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 C18H19NO3S MW 329.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO3S/c1-12(2)14-7-4-13(5-8-14)6-9-16(20)19-15-10-11-23-17(15)18(21)22-3/h4-12H,1-3H3,(H,19,20)/b9-6+InChIKey
PAZOBSPOVVBWIJ-RMKNXTFCSA-NSynonyms
CC(C)C1=CC=C(C=C1)C=CC(=O)NC2=C(SC=C2)C(=O)OC
COC(=O)c1sccc1NC(=O)C=Cc1ccc(cc1)C(C)C
InChI=1SC18H19NO3Sc112(2)147413(5814)6916(20)191510112317(15)18(21)223h412H13H3(H1920)b96+
methyl3(((2E)3(4(propan2yl)phenyl)prop2enoyl)amino)thiophene2carboxylate
METHYL3(((E)3(4PROPAN2YLPHENYL)PROP2ENOYL)AMINO)THIOPHENE2CARBOXYLATE
METHYL3((2E)3(4(METHYLETHYL)PHENYL)PROP2ENOYLAMINO)THIOPHENE2CARBOXYLATE
MFCD01344422
ZINC000005020977
ZINC05020977
ZINC5020977
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