Vitas-M small molecule compound
methyl 2-{[(3,5-dinitrophenyl)carbonyl]amino}-4-(3-methylphenyl)thiophene-3-carboxylate
Catalog ID
STK316736
SMILES COC(=O)c1c(scc1c1cccc(c1)C)NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]
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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 C20H15N3O7S MW 441.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N3O7S/c1-11-4-3-5-12(6-11)16-10-31-19(17(16)20(25)30-2)21-18(24)13-7-14(22(26)27)9-15(8-13)23(28)29/h3-10H,1-2H3,(H,21,24)InChIKey
LZMMZKXQXPNGDQ-UHFFFAOYSA-NSynonyms
445005-79-8445005798
CC1=CC=CC(=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3=CC(=CC(=C3)(N+)(=O)(O))(N+)(=O)(O)
COC(=O)c1c(scc1c1cccc(c1)C)NC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC20H15N3O7Sc11143512(611)16103119(17(16)20(25)302)2118(24)13714(22(26)27)915(813)23(28)29h310H12H3(H2124)
methyl2(((35dinitrophenyl)carbonyl)amino)4(3methylphenyl)thiophene3carboxylate
METHYL2((35BISNITROBENZOYL)AMINO)4(3METHYLPHENYL)THIOPHENE3CARBOXYLATE
METHYL2((35DINITROBENZOYL)AMINO)4(3METHYLPHENYL)THIOPHENE3CARBOXYLATE
MFCD02607390
ZINC000002102244
ZINC02102244
ZINC2102244
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