N-(4-fluorophenyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide

Systemtic Name: N-(4-fluorophenyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide Openeye Name: N-(4-fluorophenyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide CAS Name: N-(4-fluorophenyl)-4-(4-nitrophenyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-fluorophenyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide Traditional Name: N-(4-fluorophenyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide Formula: C17H17FN4O2S MolecularWeight: 360.405883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=S)NC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=S)NC3=CC=C(C=C3)F

InChI

InChI=1S/C17H17FN4O2S/c18-13-1-3-14(4-2-13)19-17(25)21-11-9-20(10-12-21)15-5-7-16(8-6-15)22(23)24/h1-8H,9-12H2,(H,19,25)