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

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-4-(4-cyanophenyl)piperazine-1-carbothioamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-4-(4-cyanophenyl)piperazine-1-carbothioamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-4-(4-cyanophenyl)-1-piperazinecarbothioamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-4-(4-cyanophenyl)piperazine-1-carbothioamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-4-(4-cyanophenyl)piperazine-1-carbothioamide Formula: C20H21ClN4S MolecularWeight: 384.92554

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)C#N)C(=S)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)C#N)C(=S)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21ClN4S/c21-18-5-1-16(2-6-18)9-10-23-20(26)25-13-11-24(12-14-25)19-7-3-17(15-22)4-8-19/h1-8H,9-14H2,(H,23,26)