Vitas-M small molecule compound
N-[(2-hydroxy-3,5-dimethylphenyl)carbamothioyl]-2-methyl-3-nitrobenzamide
Catalog ID
STK002008
SMILES S=C(Nc1cc(C)cc(c1O)C)NC(=O)c1cccc(c1C)[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 C17H17N3O4S MW 359.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O4S/c1-9-7-10(2)15(21)13(8-9)18-17(25)19-16(22)12-5-4-6-14(11(12)3)20(23)24/h4-8,21H,1-3H3,(H2,18,19,22,25)InChIKey
JORFYQMCORAHMN-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C(=C1)NC(=S)NC(=O)C2=C(C(=CC=C2)(N+)(=O)(O))C)O)C
InChI=1SC17H17N3O4Sc19710(2)15(21)13(89)1817(25)1916(22)1254614(11(12)3)20(23)24h4821H13H3(H218192225)
MFCD02915060
N(((2HYDROXY35DIMETHYLPHENYL)AMINO)THIOXOMETHYL)(2METHYL3NITROPHENYL)CARBOXAMIDE
N((2HYDROXY35DIMETHYLPHENYL)CARBAMOTHIOYL)2METHYL3NITROBENZAMIDE
S=C(Nc1cc(C)cc(c1O)C)NC(=O)c1cccc(c1C)(N+)(=O)(O)
STK002008
ZINC000004091252
ZINC04091252
ZINC4091252
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