Vitas-M small molecule compound
propan-2-yl 4,5-dimethyl-2-{[(2E)-3-(3-nitrophenyl)prop-2-enoyl]amino}thiophene-3-carboxylate
Catalog ID
STK447570
SMILES CC(OC(=O)c1c(NC(=O)/C=C/c2cccc(c2)[N+](=O)[O-])sc(c1C)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 C19H20N2O5S MW 388.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O5S/c1-11(2)26-19(23)17-12(3)13(4)27-18(17)20-16(22)9-8-14-6-5-7-15(10-14)21(24)25/h5-11H,1-4H3,(H,20,22)/b9-8+InChIKey
XTRJAXWWRSBCGC-CMDGGOBGSA-NSynonyms
CC(OC(=O)c1c(NC(=O)C=Cc2cccc(c2)(N+)(=O)(O))sc(c1C)C)C
CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C=CC2=CC(=CC=C2)(N+)(=O)(O))C
InChI=1SC19H20N2O5Sc111(2)2619(23)1712(3)13(4)2718(17)2016(22)981465715(1014)21(24)25h511H14H3(H2022)b98+
METHYLETHYL2((2E)3(3NITROPHENYL)PROP2ENOYLAMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
MFCD01344281
propan2yl45dimethyl2(((2E)3(3nitrophenyl)prop2enoyl)amino)thiophene3carboxylate
PROPAN2YL45DIMETHYL2(((E)3(3NITROPHENYL)PROP2ENOYL)AMINO)THIOPHENE3CARBOXYLATE
ZINC000005533596
ZINC05533596
ZINC5533596
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