Vitas-M small molecule compound
dipropan-2-yl 5-{[(2E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino}-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STK428396
SMILES CC(OC(=O)c1c(NC(=O)/C=C/c2ccc3c(c2)OCO3)sc(c1C)C(=O)OC(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 C23H25NO7S MW 459.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25NO7S/c1-12(2)30-22(26)19-14(5)20(23(27)31-13(3)4)32-21(19)24-18(25)9-7-15-6-8-16-17(10-15)29-11-28-16/h6-10,12-13H,11H2,1-5H3,(H,24,25)/b9-7+InChIKey
AHMALSNAWPWMSB-VQHVLOKHSA-NSynonyms
CC(OC(=O)c1c(NC(=O)C=Cc2ccc3c(c2)OCO3)sc(c1C)C(=O)OC(C)C)C
CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C=CC2=CC3=C(C=C2)OCO3)C(=O)OC(C)C
dipropan2yl5(((2E)3(13benzodioxol5yl)prop2enoyl)amino)3methylthiophene24dicarboxylate
DIPROPAN2YL5(((E)3(13BENZODIOXOL5YL)PROP2ENOYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
InChI=1SC23H25NO7Sc112(2)3022(26)1914(5)20(23(27)3113(3)4)3221(19)2418(25)9715681617(1015)29112816h6101213H11H215H3(H2425)b97+
METHYLETHYL5((2E)3(2HBENZO(34D)13DIOXOLAN5YL)PROP2ENOYLAMINO)3METHYL4((METHYLETHYL)OXYCARBONYL)THIOPHENE2CARBOXYLATE
MFCD01358640
ZINC000001217858
ZINC01217858
ZINC1217858
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