[4-[4-[(4-chlorophenyl)sulfanylmethyl]phenyl]carbonylpiperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[4-[(4-chlorophenyl)sulfanylmethyl]phenyl]carbonylpiperazin-1-yl]-phenyl-methanone Openeye Name: [4-[4-[(4-chlorophenyl)sulfanylmethyl]benzoyl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[[4-[[(4-chlorophenyl)thio]methyl]phenyl]-oxomethyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[4-[(4-chlorophenyl)sulfanylmethyl]benzoyl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[4-[[(4-chlorophenyl)thio]methyl]benzoyl]piperazino]-phenyl-methanone Formula: C25H23ClN2O2S MolecularWeight: 450.98032

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)CSC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H23ClN2O2S/c26-22-10-12-23(13-11-22)31-18-19-6-8-21(9-7-19)25(30)28-16-14-27(15-17-28)24(29)20-4-2-1-3-5-20/h1-13H,14-18H2