Vitas-M small molecule compound
3-methoxy-N-{[6-methyl-2-(4-methylphenyl)-2H-benzotriazol-5-yl]carbamothioyl}benzamide
Catalog ID
STL377401
SMILES COc1cccc(c1)C(=O)NC(=S)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 C23H21N5O2S MW 431.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N5O2S/c1-14-7-9-17(10-8-14)28-26-20-11-15(2)19(13-21(20)27-28)24-23(31)25-22(29)16-5-4-6-18(12-16)30-3/h4-13H,1-3H3,(H2,24,25,29,31)InChIKey
PPNSLYQXINSCBH-UHFFFAOYSA-NSynonyms
3methoxyN((6methyl2(4methylphenyl)2Hbenzotriazol5yl)carbamothioyl)benzamide
3METHOXYN((6METHYL2(4METHYLPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)C4=CC(=CC=C4)OC)C
InChI=1SC23H21N5O2Sc1147917(10814)2826201115(2)19(1321(20)2728)2423(31)2522(29)1654618(1216)303h413H13H3(H224252931)
MFCD02630922
N(3METHOXYBENZOYL)N(6METHYL2(4METHYLPHENYL)2H123BENZOTRIAZOL5YL)THIOUREA
ZINC000000980498
ZINC00980498
ZINC980498
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