N-[2-(3-chlorophenyl)-1-phenyl-ethyl]-4-phenyl-piperazine-1-carbothioamide

Systemtic Name: N-[2-(3-chlorophenyl)-1-phenyl-ethyl]-4-phenyl-piperazine-1-carbothioamide Openeye Name: N-[2-(3-chlorophenyl)-1-phenyl-ethyl]-4-phenyl-piperazine-1-carbothioamide CAS Name: N-[2-(3-chlorophenyl)-1-phenylethyl]-4-phenyl-1-piperazinecarbothioamide IUPAC Name: N-[2-(3-chlorophenyl)-1-phenylethyl]-4-phenylpiperazine-1-carbothioamide Traditional Name: N-[2-(3-chlorophenyl)-1-phenyl-ethyl]-4-phenyl-piperazine-1-carbothioamide Formula: C25H26ClN3S MolecularWeight: 436.01204

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=S)NC(CC3=CC(=CC=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=S)NC(CC3=CC(=CC=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C25H26ClN3S/c26-22-11-7-8-20(18-22)19-24(21-9-3-1-4-10-21)27-25(30)29-16-14-28(15-17-29)23-12-5-2-6-13-23/h1-13,18,24H,14-17,19H2,(H,27,30)