(2-phenylsulfanylpyridin-3-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone

Systemtic Name: (2-phenylsulfanylpyridin-3-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone Openeye Name: (2-phenylsulfanyl-3-pyridyl)-[4-(1-piperidyl)-1-piperidyl]methanone CAS Name: [2-(phenylthio)-3-pyridinyl]-[4-(1-piperidinyl)-1-piperidinyl]methanone IUPAC Name: (2-phenylsulfanylpyridin-3-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone Traditional Name: [2-(phenylthio)-3-pyridyl]-(4-piperidinopiperidino)methanone Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)C(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)C(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C22H27N3OS/c26-22(25-16-11-18(12-17-25)24-14-5-2-6-15-24)20-10-7-13-23-21(20)27-19-8-3-1-4-9-19/h1,3-4,7-10,13,18H,2,5-6,11-12,14-17H2