4-(3-chlorophenyl)-N-ethyl-piperazine-1-carbothioamide

Systemtic Name: 4-(3-chlorophenyl)-N-ethyl-piperazine-1-carbothioamide Openeye Name: 4-(3-chlorophenyl)-N-ethyl-piperazine-1-carbothioamide CAS Name: 4-(3-chlorophenyl)-N-ethyl-1-piperazinecarbothioamide IUPAC Name: 4-(3-chlorophenyl)-N-ethylpiperazine-1-carbothioamide Traditional Name: 4-(3-chlorophenyl)-N-ethyl-piperazine-1-carbothioamide Formula: C13H18ClN3S MolecularWeight: 283.82012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CCN(CC1)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCNC(=S)N1CCN(CC1)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C13H18ClN3S/c1-2-15-13(18)17-8-6-16(7-9-17)12-5-3-4-11(14)10-12/h3-5,10H,2,6-9H2,1H3,(H,15,18)