Vitas-M small molecule compound
4-butoxy-N-[(2-methyl-4-nitrophenyl)carbamothioyl]benzamide
Catalog ID
STK077988
SMILES CCCCOc1ccc(cc1)C(=O)NC(=S)Nc1ccc(cc1C)[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 C19H21N3O4S MW 387.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O4S/c1-3-4-11-26-16-8-5-14(6-9-16)18(23)21-19(27)20-17-10-7-15(22(24)25)12-13(17)2/h5-10,12H,3-4,11H2,1-2H3,(H2,20,21,23,27)InChIKey
MLDZPUMISSBVPG-UHFFFAOYSA-NSynonyms
4BUTOXYN((2METHYL4NITROPHENYL)CARBAMOTHIOYL)BENZAMIDE
CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)(N+)(=O)(O))C
CCCCOc1ccc(cc1)C(=O)NC(=S)Nc1ccc(cc1C)(N+)(=O)(O)
InChI=1SC19H21N3O4Sc1341126168514(6916)18(23)2119(27)201710715(22(24)25)1213(17)2h51012H3411H212H3(H220212327)
MFCD02626845
STK077988
ZINC000004662875
ZINC04662875
ZINC4662875
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