Vitas-M small molecule compound
2-{[5-benzyl-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethanone
Catalog ID
STL376799
SMILES Clc1ccc(cc1)n1c(SCC(=O)N2CCN(CC2)c2ccccc2)nnc1Cc1ccccc1
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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 C27H26ClN5OS MW 504.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN5OS/c28-22-11-13-24(14-12-22)33-25(19-21-7-3-1-4-8-21)29-30-27(33)35-20-26(34)32-17-15-31(16-18-32)23-9-5-2-6-10-23/h1-14H,15-20H2InChIKey
IWGRGJGQYIUMIJ-UHFFFAOYSA-NSynonyms
2((5BENZYL4(4CHLOROPHENYL)124TRIAZOL3YL)SULFANYL)1(4PHENYLPIPERAZIN1YL)ETHANONE
2((5benzyl4(4chlorophenyl)4H124triazol3yl)sulfanyl)1(4phenylpiperazin1yl)ethanone
C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NN=C(N3C4=CC=C(C=C4)Cl)CC5=CC=CC=C5
InChI=1SC27H26ClN5OSc2822111324(141222)3325(19217314821)293027(33)352026(34)32171531(161832)2395261023h114H1520H2
MFCD06629387
ZINC000002883106
ZINC02883106
ZINC2883106
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