Vitas-M small molecule compound
methyl 2-{[(2E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK467224
SMILES COC(=O)c1sc(nc1C)NC(=O)/C=C/c1ccc2c(c1)OCO2
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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 C16H14N2O5S MW 346.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N2O5S/c1-9-14(15(20)21-2)24-16(17-9)18-13(19)6-4-10-3-5-11-12(7-10)23-8-22-11/h3-7H,8H2,1-2H3,(H,17,18,19)/b6-4+InChIKey
ODUPODMAMBHMTN-GQCTYLIASA-NSynonyms
CC1=C(SC(=N1)NC(=O)C=CC2=CC3=C(C=C2)OCO3)C(=O)OC
COC(=O)c1sc(nc1C)NC(=O)C=Cc1ccc2c(c1)OCO2
InChI=1SC16H14N2O5Sc1914(15(20)212)2416(179)1813(19)6410351112(710)2382211h37H8H212H3(H171819)b64+
methyl2(((2E)3(13benzodioxol5yl)prop2enoyl)amino)4methyl13thiazole5carboxylate
METHYL2(((E)3(13BENZODIOXOL5YL)PROP2ENOYL)AMINO)4METHYL13THIAZOLE5CARBOXYLATE
METHYL2((2E)3(2HBENZO(D)13DIOXOLAN5YL)PROP2ENOYLAMINO)4METHYL13THIAZOLE5CARBOXYLATE
MFCD03389732
ZINC000006254970
ZINC06254970
ZINC6254970
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