Vitas-M small molecule compound
2-chloro-4-nitro-N-{[2-(pyrrolidin-1-yl)-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide
Catalog ID
STK336671
SMILES S=C(NC(=O)c1ccc(cc1Cl)[N+](=O)[O-])Nc1cc(ccc1N1CCCC1)C(F)(F)F
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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 C19H16ClF3N4O3S MW 472.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClF3N4O3S/c20-14-10-12(27(29)30)4-5-13(14)17(28)25-18(31)24-15-9-11(19(21,22)23)3-6-16(15)26-7-1-2-8-26/h3-6,9-10H,1-2,7-8H2,(H2,24,25,28,31)InChIKey
HXMYZGCVWCIHQP-UHFFFAOYSA-NSynonyms
(2CHLORO4NITROPHENYL)N(((2PYRROLIDINYL5(TRIFLUOROMETHYL)PHENYL)AMINO)THIOXOMETHYL)CARBOXAMIDE
1(2CHLORO4NITROBENZOYL)3(2PYRROLIDIN1YL5TRIFLUOROMETHYLPHENYL)THIOUREA
2chloro4nitroN((2(pyrrolidin1yl)5(trifluoromethyl)phenyl)carbamothioyl)benzamide
2CHLORO4NITRON((2PYRROLIDIN1YL5(TRIFLUOROMETHYL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=S)NC(=O)C3=C(C=C(C=C3)(N+)(=O)(O))Cl
InChI=1SC19H16ClF3N4O3Sc20141012(27(29)30)4513(14)17(28)2518(31)2415911(19(2122)23)3616(15)26712826h36910H1278H2(H224252831)
MFCD05661414
S=C(NC(=O)c1ccc(cc1Cl)(N+)(=O)(O))Nc1cc(ccc1N1CCCC1)C(F)(F)F
ZINC000004109836
ZINC04109836
ZINC4109836
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