Vitas-M small molecule compound
N-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamothioyl]-3-nitrobenzamide
Catalog ID
STK873201
SMILES S=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)NC(=O)c1cccc(c1)[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 C19H17N5O4S MW 411.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N5O4S/c1-12-16(18(26)23(22(12)2)14-8-4-3-5-9-14)20-19(29)21-17(25)13-7-6-10-15(11-13)24(27)28/h3-11H,1-2H3,(H2,20,21,25,29)InChIKey
MWLKPEUOCRDKLJ-UHFFFAOYSA-NSynonyms
380622-96-8380622968
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NC(=O)C3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC19H17N5O4Sc11216(18(26)23(22(12)2)148435914)2019(29)2117(25)13761015(1113)24(27)28h311H12H3(H220212529)
MFCD01411593
N(((23DIMETHYL5OXO1PHENYL(3PYRAZOLIN4YL))AMINO)THIOXOMETHYL)(3NITROPHENYL)CARBOXAMIDE
N((15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)carbamothioyl)3nitrobenzamide
N((15DIMETHYL3OXO2PHENYLPYRAZOL4YL)CARBAMOTHIOYL)3NITROBENZAMIDE
S=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)NC(=O)c1cccc(c1)(N+)(=O)(O)
ZINC000001462270
ZINC1462270
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