Vitas-M small molecule compound
2,5-dichloro-N-{[6-chloro-2-(4-methylphenyl)-2H-benzotriazol-5-yl]carbamothioyl}benzamide
Catalog ID
STK183904
SMILES S=C(NC(=O)c1cc(Cl)ccc1Cl)Nc1cc2nn(nc2cc1Cl)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 C21H14Cl3N5OS MW 490.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14Cl3N5OS/c1-11-2-5-13(6-3-11)29-27-18-9-16(24)17(10-19(18)28-29)25-21(31)26-20(30)14-8-12(22)4-7-15(14)23/h2-10H,1H3,(H2,25,26,30,31)InChIKey
PPLAPSCKLQNADM-UHFFFAOYSA-NSynonyms
25DICHLORON((6CHLORO2(4METHYLPHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
25dichloroN((6chloro2(4methylphenyl)benzotriazol5yl)carbamothioyl)benzamide
CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=S)NC(=O)C4=C(C=CC(=C4)Cl)Cl
InChI=1SC21H14Cl3N5OSc1112513(6311)292718916(24)17(1019(18)2829)2521(31)2620(30)14812(22)4715(14)23h210H1H3(H225263031)
MFCD06664464
ZINC000009906331
ZINC09906331
ZINC9906331
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