Vitas-M small molecule compound
3-bromo-N-{[6-methyl-2-(4-methylphenyl)-2H-benzotriazol-5-yl]carbamothioyl}benzamide
Catalog ID
STK026461
SMILES S=C(NC(=O)c1cccc(c1)Br)Nc1cc2nn(nc2cc1C)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 C22H18BrN5OS MW 480.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrN5OS/c1-13-6-8-17(9-7-13)28-26-19-10-14(2)18(12-20(19)27-28)24-22(30)25-21(29)15-4-3-5-16(23)11-15/h3-12H,1-2H3,(H2,24,25,29,30)InChIKey
QXPRGCLTGYCSRP-UHFFFAOYSA-NSynonyms
3BROMON((6METHYL2(4METHYLPHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
3BROMON((6METHYL2(4METHYLPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)C4=CC(=CC=C4)Br)C
InChI=1SC22H18BrN5OSc1136817(9713)2826191014(2)18(1220(19)2728)2422(30)2521(29)1543516(23)1115h312H12H3(H224252930)
MFCD03135022
S=C(NC(=O)c1cccc(c1)Br)Nc1cc2nn(nc2cc1C)c1ccc(cc1)C
STK026461
ZINC000002979063
ZINC02979063
ZINC2979063
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