Vitas-M small molecule compound
dimethyl 3-methyl-5-{[(2E)-3-(4-nitrophenyl)prop-2-enoyl]amino}thiophene-2,4-dicarboxylate
Catalog ID
STK435544
SMILES COC(=O)c1c(NC(=O)/C=C/c2ccc(cc2)[N+](=O)[O-])sc(c1C)C(=O)OC
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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 C18H16N2O7S MW 404.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O7S/c1-10-14(17(22)26-2)16(28-15(10)18(23)27-3)19-13(21)9-6-11-4-7-12(8-5-11)20(24)25/h4-9H,1-3H3,(H,19,21)/b9-6+InChIKey
FDKGCODVHNABQG-RMKNXTFCSA-NSynonyms
CC1=C(SC(=C1C(=O)OC)NC(=O)C=CC2=CC=C(C=C2)(N+)(=O)(O))C(=O)OC
COC(=O)c1c(NC(=O)C=Cc2ccc(cc2)(N+)(=O)(O))sc(c1C)C(=O)OC
dimethyl3methyl5(((2E)3(4nitrophenyl)prop2enoyl)amino)thiophene24dicarboxylate
DIMETHYL3METHYL5(((E)3(4NITROPHENYL)PROP2ENOYL)AMINO)THIOPHENE24DICARBOXYLATE
DIMETHYL5((3(4NITROPHENYL)ACRYLOYL)AMINO)3METHYL24THIOPHENEDICARBOXYLATE
InChI=1SC18H16N2O7Sc11014(17(22)262)16(2815(10)18(23)273)1913(21)96114712(8511)20(24)25h49H13H3(H1921)b96+
METHYL2((2E)3(4NITROPHENYL)PROP2ENOYLAMINO)5(METHOXYCARBONYL)4METHYLTHIOPHENE3CARBOXYLATE
MFCD03363104
ZINC000002745504
ZINC02745504
ZINC2745504
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