[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-[4-(2-phenylsulfanylethoxy)phenyl]methanone

Systemtic Name: [4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-[4-(2-phenylsulfanylethoxy)phenyl]methanone Openeye Name: [4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-[4-(2-phenylsulfanylethoxy)phenyl]methanone CAS Name: [4-(5-chloro-2-methylphenyl)-1-piperazinyl]-[4-[2-(phenylthio)ethoxy]phenyl]methanone IUPAC Name: [4-(5-chloro-2-methylphenyl)piperazin-1-yl]-[4-(2-phenylsulfanylethoxy)phenyl]methanone Traditional Name: [4-(5-chloro-2-methyl-phenyl)piperazino]-[4-[2-(phenylthio)ethoxy]phenyl]methanone Formula: C26H27ClN2O2S MolecularWeight: 467.02278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OCCSC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OCCSC4=CC=CC=C4

InChI

InChI=1S/C26H27ClN2O2S/c1-20-7-10-22(27)19-25(20)28-13-15-29(16-14-28)26(30)21-8-11-23(12-9-21)31-17-18-32-24-5-3-2-4-6-24/h2-12,19H,13-18H2,1H3