Vitas-M small molecule compound
2-{[4-methyl-5-(naphthalen-1-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethanone
Catalog ID
STK134976
SMILES O=C(N1CCN(CC1)c1ccccc1)CSc1nnc(n1C)Cc1cccc2c1cccc2
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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 C26H27N5OS MW 457.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5OS/c1-29-24(18-21-10-7-9-20-8-5-6-13-23(20)21)27-28-26(29)33-19-25(32)31-16-14-30(15-17-31)22-11-3-2-4-12-22/h2-13H,14-19H2,1H3InChIKey
QVNHSMLTPNGQCW-UHFFFAOYSA-NSynonyms
499117-37-22((4METHYL5(NAPHTHALEN1YLMETHYL)124TRIAZOL3YL)SULFANYL)1(4PHENYLPIPERAZIN1YL)ETHANONE
2((4METHYL5(NAPHTHALEN1YLMETHYL)4H124TRIAZOL3YL)SULFANYL)1(4PHENYLPIPERAZIN1YL)ETHANONE
2((4methyl5(naphthalen1ylmethyl)4H124triazol3yl)thio)1(4phenylpiperazin1yl)ethanone
2(4METHYL5NAPHTHALEN1YLMETHYL4H(124)TRIAZOL3YLSULFANYL)1(4PHENYLPIPERAZIN1YL)ETHANONE
499117372
CN1C(=NN=C1SCC(=O)N2CCN(CC2)C3=CC=CC=C3)CC4=CC=CC5=CC=CC=C54
InChI=1SC26H27N5OSc12924(18211079208561323(20)21)272826(29)331925(32)31161430(151731)22113241222h213H1419H21H3
MFCD03302496
ZINC000008666962
ZINC08666962
ZINC8666962
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