Vitas-M small molecule compound
N-(3-chloro-2-methylphenyl)-2-[(5-{[(2,6-dimethylphenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Catalog ID
STL186098
SMILES O=C(Nc1cccc(c1C)Cl)CSc1nnc(n1c1ccccc1)CNc1c(C)cccc1C
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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 C26H26ClN5OS MW 492.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN5OS/c1-17-9-7-10-18(2)25(17)28-15-23-30-31-26(32(23)20-11-5-4-6-12-20)34-16-24(33)29-22-14-8-13-21(27)19(22)3/h4-14,28H,15-16H2,1-3H3,(H,29,33)InChIKey
XLBCPIOSANFVIP-UHFFFAOYSA-NSynonyms
539810-14-5539810145
CC1=C(C(=CC=C1)C)NCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NC4=C(C(=CC=C4)Cl)C
InChI=1SC26H26ClN5OSc117971018(2)25(17)281523303126(32(23)20115461220)341624(33)29221481321(27)19(22)3h41428H1516H213H3(H2933)
MFCD03460844
N(3chloro2methylphenyl)2((5(((26dimethylphenyl)amino)methyl)4phenyl4H124triazol3yl)sulfanyl)acetamide
N(3CHLORO2METHYLPHENYL)2((5(((26DIMETHYLPHENYL)AMINO)METHYL)4PHENYL4H124TRIAZOL3YL)THIO)ACETAMIDE
N(3CHLORO2METHYLPHENYL)2((5((26DIMETHYLANILINO)METHYL)4PHENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000002507700
ZINC02507700
ZINC2507700
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