1-[2-[(4-chlorophenyl)-phenyl-methyl]sulfanylethyl]-4-(4-methoxyphenyl)piperazine

Systemtic Name: 1-[2-[(4-chlorophenyl)-phenyl-methyl]sulfanylethyl]-4-(4-methoxyphenyl)piperazine Openeye Name: 1-[2-[(4-chlorophenyl)-phenyl-methyl]sulfanylethyl]-4-(4-methoxyphenyl)piperazine CAS Name: 1-[2-[[(4-chlorophenyl)-phenylmethyl]thio]ethyl]-4-(4-methoxyphenyl)piperazine IUPAC Name: 1-[2-[(4-chlorophenyl)-phenylmethyl]sulfanylethyl]-4-(4-methoxyphenyl)piperazine Traditional Name: 1-[2-[[(4-chlorophenyl)-phenyl-methyl]thio]ethyl]-4-(4-methoxyphenyl)piperazine Formula: C26H29ClN2OS MolecularWeight: 453.03926

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCSC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCSC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H29ClN2OS/c1-30-25-13-11-24(12-14-25)29-17-15-28(16-18-29)19-20-31-26(21-5-3-2-4-6-21)22-7-9-23(27)10-8-22/h2-14,26H,15-20H2,1H3