[2-(4-methylphenyl)sulfanylpyridin-3-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [2-(4-methylphenyl)sulfanylpyridin-3-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: (4-phenylpiperazin-1-yl)-[2-(p-tolylsulfanyl)-3-pyridyl]methanone CAS Name: [2-[(4-methylphenyl)thio]-3-pyridinyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [2-(4-methylphenyl)sulfanylpyridin-3-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: (4-phenylpiperazino)-[2-(p-tolylthio)-3-pyridyl]methanone Formula: C23H23N3OS MolecularWeight: 389.51322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H23N3OS/c1-18-9-11-20(12-10-18)28-22-21(8-5-13-24-22)23(27)26-16-14-25(15-17-26)19-6-3-2-4-7-19/h2-13H,14-17H2,1H3