[4-(2-methoxyphenyl)piperazin-1-yl]-[2-[(2-methylphenyl)methylsulfanyl]pyridin-3-yl]methanone

Systemtic Name: [4-(2-methoxyphenyl)piperazin-1-yl]-[2-[(2-methylphenyl)methylsulfanyl]pyridin-3-yl]methanone Openeye Name: [4-(2-methoxyphenyl)piperazin-1-yl]-[2-(o-tolylmethylsulfanyl)-3-pyridyl]methanone CAS Name: [4-(2-methoxyphenyl)-1-piperazinyl]-[2-[(2-methylphenyl)methylthio]-3-pyridinyl]methanone IUPAC Name: [4-(2-methoxyphenyl)piperazin-1-yl]-[2-[(2-methylphenyl)methylsulfanyl]pyridin-3-yl]methanone Traditional Name: [4-(2-methoxyphenyl)piperazino]-[2-[(2-methylbenzyl)thio]-3-pyridyl]methanone Formula: C25H27N3O2S MolecularWeight: 433.56578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=C(C=CC=N2)C(=O)N3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CC1=CC=CC=C1CSC2=C(C=CC=N2)C(=O)N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C25H27N3O2S/c1-19-8-3-4-9-20(19)18-31-24-21(10-7-13-26-24)25(29)28-16-14-27(15-17-28)22-11-5-6-12-23(22)30-2/h3-13H,14-18H2,1-2H3