Vitas-M small molecule compound

N-(2,5-dimethylphenyl)-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK575220
SMILES Cc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)ccc2C)nnc1c1cccc(c1)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 C26H26N4OS MW 442.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4OS/c1-17-9-12-22(13-10-17)30-25(21-7-5-6-18(2)14-21)28-29-26(30)32-16-24(31)27-23-15-19(3)8-11-20(23)4/h5-15H,16H2,1-4H3,(H,27,31)
InChIKey
JVSWQVZRZRLOLZ-UHFFFAOYSA-N
Synonyms
849026-99-9
849026999
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=CC(=C3)C)C)C4=CC(=CC=C4)C
InChI=1SC26H26N4OSc11791222(131017)3025(2175618(2)1421)282926(30)321624(31)27231519(3)81120(23)4h515H16H214H3(H2731)
MFCD05681468
N(25DIMETHYLPHENYL)2((5(3METHYLPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(25dimethylphenyl)2((5(3methylphenyl)4(4methylphenyl)4H124triazol3yl)sulfanyl)acetamide
N(25dimethylphenyl)2((5(mtolyl)4(ptolyl)4H124triazol3yl)thio)acetamide
N(25DIMETHYLPHENYL)2(4(4METHYLPHENYL)5(3METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002453541
ZINC02453541
ZINC2453541

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.