Vitas-M small molecule compound
4-methoxy-N-{[2-(4-methylphenyl)-2H-benzotriazol-5-yl]carbamothioyl}benzamide
Catalog ID
STK003497
SMILES COc1ccc(cc1)C(=O)NC(=S)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 C22H19N5O2S MW 417.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N5O2S/c1-14-3-8-17(9-4-14)27-25-19-12-7-16(13-20(19)26-27)23-22(30)24-21(28)15-5-10-18(29-2)11-6-15/h3-13H,1-2H3,(H2,23,24,28,30)InChIKey
NDFILIFKTLOECF-UHFFFAOYSA-NSynonyms
4METHOXYN((2(4METHYLPHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
4METHOXYN((2(4METHYLPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
CC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC=C(C=C4)OC
COc1ccc(cc1)C(=O)NC(=S)Nc1ccc2c(c1)nn(n2)c1ccc(cc1)C
InChI=1SC22H19N5O2Sc1143817(9414)27251912716(1320(19)2627)2322(30)2421(28)1551018(292)11615h313H12H3(H223242830)
MFCD02625257
STK003497
ZINC000001410563
ZINC01410563
ZINC1410563
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