[4-(2-phenoxyethyl)piperazin-1-yl]-(2-phenylsulfanylpyridin-3-yl)methanone

Systemtic Name: [4-(2-phenoxyethyl)piperazin-1-yl]-(2-phenylsulfanylpyridin-3-yl)methanone Openeye Name: [4-(2-phenoxyethyl)piperazin-1-yl]-(2-phenylsulfanyl-3-pyridyl)methanone CAS Name: [4-(2-phenoxyethyl)-1-piperazinyl]-[2-(phenylthio)-3-pyridinyl]methanone IUPAC Name: [4-(2-phenoxyethyl)piperazin-1-yl]-(2-phenylsulfanylpyridin-3-yl)methanone Traditional Name: [4-(2-phenoxyethyl)piperazino]-[2-(phenylthio)-3-pyridyl]methanone Formula: C24H25N3O2S MolecularWeight: 419.5392

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC=CC=C2)C(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCOC2=CC=CC=C2)C(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C24H25N3O2S/c28-24(22-12-7-13-25-23(22)30-21-10-5-2-6-11-21)27-16-14-26(15-17-27)18-19-29-20-8-3-1-4-9-20/h1-13H,14-19H2