Vitas-M small molecule compound
methyl 5-methyl-2-{[(2-nitrophenyl)carbamothioyl]amino}thiophene-3-carboxylate
Catalog ID
STK456386
SMILES COC(=O)c1cc(sc1NC(=S)Nc1ccccc1[N+](=O)[O-])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 C14H13N3O4S2 MW 351.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13N3O4S2/c1-8-7-9(13(18)21-2)12(23-8)16-14(22)15-10-5-3-4-6-11(10)17(19)20/h3-7H,1-2H3,(H2,15,16,22)InChIKey
LHEGMDRMXSIWIB-UHFFFAOYSA-NSynonyms
CC1=CC(=C(S1)NC(=S)NC2=CC=CC=C2(N+)(=O)(O))C(=O)OC
COC(=O)c1cc(sc1NC(=S)Nc1ccccc1(N+)(=O)(O))C
InChI=1SC14H13N3O4S2c1879(13(18)212)12(238)1614(22)1510534611(10)17(19)20h37H12H3(H2151622)
METHYL5METHYL2((((2NITROPHENYL)AMINO)THIOXOMETHYL)AMINO)THIOPHENE3CARBOXYLATE
methyl5methyl2(((2nitrophenyl)carbamothioyl)amino)thiophene3carboxylate
METHYL5METHYL2((2NITROPHENYL)CARBAMOTHIOYLAMINO)THIOPHENE3CARBOXYLATE
MFCD05991065
ZINC000005041809
ZINC05041809
ZINC5041809
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