N-(3-chloranyl-4-fluoranyl-phenyl)-4-(4-fluorophenyl)piperazine-1-carbothioamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-4-(4-fluorophenyl)piperazine-1-carbothioamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-4-(4-fluorophenyl)piperazine-1-carbothioamide CAS Name: N-(3-chloro-4-fluorophenyl)-4-(4-fluorophenyl)-1-piperazinecarbothioamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-4-(4-fluorophenyl)piperazine-1-carbothioamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-4-(4-fluorophenyl)piperazine-1-carbothioamide Formula: C17H16ClF2N3S MolecularWeight: 367.843846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=S)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=S)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C17H16ClF2N3S/c18-15-11-13(3-6-16(15)20)21-17(24)23-9-7-22(8-10-23)14-4-1-12(19)2-5-14/h1-6,11H,7-10H2,(H,21,24)