N-[2-(4-chlorophenyl)sulfanylphenyl]-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-N-[2-(4-chlorophenyl)sulfanylphenyl]acetamide CAS Name: N-[2-[(4-chlorophenyl)thio]phenyl]-2-[4-(phenylmethyl)-1-piperazinyl]acetamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-N-[2-(4-chlorophenyl)sulfanylphenyl]acetamide Traditional Name: 2-(4-benzylpiperazino)-N-[2-[(4-chlorophenyl)thio]phenyl]acetamide Formula: C25H26ClN3OS MolecularWeight: 452.01144

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)CC(=O)NC3=CC=CC=C3SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)CC(=O)NC3=CC=CC=C3SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H26ClN3OS/c26-21-10-12-22(13-11-21)31-24-9-5-4-8-23(24)27-25(30)19-29-16-14-28(15-17-29)18-20-6-2-1-3-7-20/h1-13H,14-19H2,(H,27,30)