Vitas-M small molecule compound
3,4,5-trimethoxy-N-[(2-nitrophenyl)carbamothioyl]benzamide
Catalog ID
STK062213
SMILES COc1cc(cc(c1OC)OC)C(=O)NC(=S)Nc1ccccc1[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 C17H17N3O6S MW 391.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O6S/c1-24-13-8-10(9-14(25-2)15(13)26-3)16(21)19-17(27)18-11-6-4-5-7-12(11)20(22)23/h4-9H,1-3H3,(H2,18,19,21,27)InChIKey
YQFSMKLOBQNDOK-UHFFFAOYSA-NSynonyms
74717-17-2345TRIMETHOXYN(((2NITROPHENYL)AMINO)CARBONOTHIOYL)BENZAMIDE
345TRIMETHOXYN((2NITROPHENYL)CARBAMOTHIOYL)BENZAMIDE
74717172
BENZAMIDE345TRIMETHOXYN(((2NITROPHENYL)AMINO)THIOXOMETHYL)
COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NC2=CC=CC=C2(N+)(=O)(O)
COc1cc(cc(c1OC)OC)C(=O)NC(=S)Nc1ccccc1(N+)(=O)(O)
InChI=1SC17H17N3O6Sc12413810(914(252)15(13)263)16(21)1917(27)1811645712(11)20(22)23h49H13H3(H218192127)
MFCD02625132
STK062213
ZINC000004834508
ZINC04834508
ZINC4834508
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