Vitas-M small molecule compound
2-bromo-N-{[2-(4-methylphenyl)-2H-benzotriazol-5-yl]carbamothioyl}benzamide
Catalog ID
STL377366
SMILES S=C(NC(=O)c1ccccc1Br)Nc1ccc2c(c1)nn(n2)c1ccc(cc1)C
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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 C21H16BrN5OS MW 466.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrN5OS/c1-13-6-9-15(10-7-13)27-25-18-11-8-14(12-19(18)26-27)23-21(29)24-20(28)16-4-2-3-5-17(16)22/h2-12H,1H3,(H2,23,24,28,29)InChIKey
HPFPVNLIRSCJJF-UHFFFAOYSA-NSynonyms
(2BROMOPHENYL)N(((2(4METHYLPHENYL)(2HYDROBENZOTRIAZOL5YL))AMINO)THIOXOMETHYL)CARBOXAMIDE
2bromoN((2(4methylphenyl)2Hbenzotriazol5yl)carbamothioyl)benzamide
2BROMON((2(4METHYLPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
CC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC=CC=C4Br
InChI=1SC21H16BrN5OSc1136915(10713)27251811814(1219(18)2627)2321(29)2420(28)16423517(16)22h212H1H3(H223242829)
MFCD02630022
ZINC000001408937
ZINC01408937
ZINC1408937
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