N-butyl-4-(4-chlorophenyl)piperazine-1-carbothioamide

Systemtic Name: N-butyl-4-(4-chlorophenyl)piperazine-1-carbothioamide Openeye Name: N-butyl-4-(4-chlorophenyl)piperazine-1-carbothioamide CAS Name: N-butyl-4-(4-chlorophenyl)-1-piperazinecarbothioamide IUPAC Name: N-butyl-4-(4-chlorophenyl)piperazine-1-carbothioamide Traditional Name: N-butyl-4-(4-chlorophenyl)piperazine-1-carbothioamide Formula: C15H22ClN3S MolecularWeight: 311.87328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N1CCN(CC1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCNC(=S)N1CCN(CC1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H22ClN3S/c1-2-3-8-17-15(20)19-11-9-18(10-12-19)14-6-4-13(16)5-7-14/h4-7H,2-3,8-12H2,1H3,(H,17,20)