Vitas-M small molecule compound
N-{[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]carbamothioyl}-3,5-dimethylbenzamide
Catalog ID
STK236549
SMILES S=C(NC(=O)c1cc(C)cc(c1)C)Nc1ccc2c(c1)nn(n2)c1ccc(cc1)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 C22H18FN5OS MW 419.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18FN5OS/c1-13-9-14(2)11-15(10-13)21(29)25-22(30)24-17-5-8-19-20(12-17)27-28(26-19)18-6-3-16(23)4-7-18/h3-12H,1-2H3,(H2,24,25,29,30)InChIKey
YIXAUOJTDRBZCD-UHFFFAOYSA-NSynonyms
(35DIMETHYLPHENYL)N(((2(4FLUOROPHENYL)(2HYDROBENZOTRIAZOL5YL))AMINO)THIOXOMETHYL)CARBOXAMIDE
CC1=CC(=CC(=C1)C(=O)NC(=S)NC2=CC3=NN(N=C3C=C2)C4=CC=C(C=C4)F)C
InChI=1SC22H18FN5OSc113914(2)1115(1013)21(29)2522(30)2417581920(1217)2728(2619)186316(23)4718h312H12H3(H224252930)
MFCD03837168
N((2(4fluorophenyl)2Hbenzotriazol5yl)carbamothioyl)35dimethylbenzamide
N((2(4FLUOROPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)35DIMETHYLBENZAMIDE
ZINC000008921298
ZINC08921298
ZINC8921298
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