Vitas-M small molecule compound
methyl 4,5-dimethyl-2-{[(3-methyl-4-nitrophenyl)carbonyl]amino}thiophene-3-carboxylate
Catalog ID
STK430698
SMILES COC(=O)c1c(NC(=O)c2ccc(c(c2)C)[N+](=O)[O-])sc(c1C)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 C16H16N2O5S MW 348.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O5S/c1-8-7-11(5-6-12(8)18(21)22)14(19)17-15-13(16(20)23-4)9(2)10(3)24-15/h5-7H,1-4H3,(H,17,19)InChIKey
ZSRAXFNLTMSVDE-UHFFFAOYSA-NSynonyms
CC1=C(C=CC(=C1)C(=O)NC2=C(C(=C(S2)C)C)C(=O)OC)(N+)(=O)(O)
COC(=O)c1c(NC(=O)c2ccc(c(c2)C)(N+)(=O)(O))sc(c1C)C
InChI=1SC16H16N2O5Sc18711(5612(8)18(21)22)14(19)171513(16(20)234)9(2)10(3)2415h57H14H3(H1719)
methyl45dimethyl2(((3methyl4nitrophenyl)carbonyl)amino)thiophene3carboxylate
METHYL45DIMETHYL2((3METHYL4NITROBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
MFCD01345878
ZINC000000090857
ZINC00090857
ZINC90857
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