Vitas-M small molecule compound
2-{[5-benzyl-4-(3,4-dimethylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-chlorophenyl)acetamide
Catalog ID
STL375512
SMILES O=C(Nc1ccc(cc1)Cl)CSc1nnc(n1c1ccc(c(c1)C)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 C25H23ClN4OS MW 463.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN4OS/c1-17-8-13-22(14-18(17)2)30-23(15-19-6-4-3-5-7-19)28-29-25(30)32-16-24(31)27-21-11-9-20(26)10-12-21/h3-14H,15-16H2,1-2H3,(H,27,31)InChIKey
ONFHTDLCMSEVDE-UHFFFAOYSA-NSynonyms
2((5BENZYL4(34DIMETHYLPHENYL)124TRIAZOL3YL)SULFANYL)N(4CHLOROPHENYL)ACETAMIDE
2((5benzyl4(34dimethylphenyl)4H124triazol3yl)sulfanyl)N(4chlorophenyl)acetamide
CC1=C(C=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)Cl)CC4=CC=CC=C4)C
InChI=1SC25H23ClN4OSc11781322(1418(17)2)3023(15196435719)282925(30)321624(31)272111920(26)101221h314H1516H212H3(H2731)
MFCD03996294
ZINC000002837050
ZINC02837050
ZINC2837050
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