Vitas-M small molecule compound
1'-{[(4-cyclohexyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}-1,4'-bipiperidine-4'-carboxamide
Catalog ID
STK206723
SMILES O=C(N1CCC(CC1)(C(=O)N)N1CCCCC1)CSc1nnc(n1C1CCCCC1)c1ccccc1
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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 C27H38N6O2S MW 510.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H38N6O2S/c28-25(35)27(32-16-8-3-9-17-32)14-18-31(19-15-27)23(34)20-36-26-30-29-24(21-10-4-1-5-11-21)33(26)22-12-6-2-7-13-22/h1,4-5,10-11,22H,2-3,6-9,12-20H2,(H2,28,35)InChIKey
NPDJTDKPRSHYSZ-UHFFFAOYSA-NSynonyms
1(((4cyclohexyl5phenyl4H124triazol3yl)sulfanyl)acetyl)14bipiperidine4carboxamide
1(2((4CYCLOHEXYL5PHENYL124TRIAZOL3YL)SULFANYL)ACETYL)4PIPERIDIN1YLPIPERIDINE4CARBOXAMIDE
1(2(4CYCLOHEXYL5PHENYL(124TRIAZOL3YLTHIO))ACETYL)4PIPERIDYLPIPERIDINE4CARBOXAMIDE
C1CCC(CC1)N2C(=NN=C2SCC(=O)N3CCC(CC3)(C(=O)N)N4CCCCC4)C5=CC=CC=C5
InChI=1SC27H38N6O2Sc2825(35)27(32168391732)141831(191527)23(34)203626302924(21104151121)33(26)22126271322h145101122H23691220H2(H22835)
MFCD03759914
ZINC000009972177
ZINC9972177
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