N-[4-(4-nitrophenyl)piperazin-1-yl]carbothioylbenzamide

Systemtic Name: N-[4-(4-nitrophenyl)piperazin-1-yl]carbothioylbenzamide Openeye Name: N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]benzamide CAS Name: N-[[4-(4-nitrophenyl)-1-piperazinyl]-sulfanylidenemethyl]benzamide IUPAC Name: N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]benzamide Traditional Name: N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]benzamide Formula: C18H18N4O3S MolecularWeight: 370.42552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O3S/c23-17(14-4-2-1-3-5-14)19-18(26)21-12-10-20(11-13-21)15-6-8-16(9-7-15)22(24)25/h1-9H,10-13H2,(H,19,23,26)