Vitas-M small molecule compound
2-{[5-benzyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-bromo-2-(trifluoromethyl)phenyl]acetamide
Catalog ID
STK162582
SMILES O=C(Nc1ccc(cc1C(F)(F)F)Br)CSc1nnc(n1c1cccc(c1)C)Cc1ccccc1
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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 C25H20BrF3N4OS MW 561.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20BrF3N4OS/c1-16-6-5-9-19(12-16)33-22(13-17-7-3-2-4-8-17)31-32-24(33)35-15-23(34)30-21-11-10-18(26)14-20(21)25(27,28)29/h2-12,14H,13,15H2,1H3,(H,30,34)InChIKey
ABNLUWHHMKQNGQ-UHFFFAOYSA-NSynonyms
2((5BENZYL4(3METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N(4BROMO2(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2((5BENZYL4(3METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)N(4BROMO2(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
CC1=CC(=CC=C1)N2C(=NN=C2SCC(=O)NC3=C(C=C(C=C3)Br)C(F)(F)F)CC4=CC=CC=C4
InChI=1SC25H20BrF3N4OSc11665919(1216)3322(13177324817)313224(33)351523(34)3021111018(26)1420(21)25(2728)29h21214H1315H21H3(H3034)
MFCD03862227
ZINC000002093422
ZINC02093422
ZINC2093422
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