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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2C#N)C(=S)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2C#N)C(=S)NCCC3=CC=C(C=C3)Cl

InChI

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