(3-nitrophenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanethione

Systemtic Name: (3-nitrophenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanethione Openeye Name: (3-nitrophenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanethione CAS Name: (3-nitrophenyl)-[4-(4-nitrophenyl)-1-piperazinyl]methanethione IUPAC Name: (3-nitrophenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanethione Traditional Name: (3-nitrophenyl)-[4-(4-nitrophenyl)piperazino]methanethione Formula: C17H16N4O4S MolecularWeight: 372.39834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N4O4S/c22-20(23)15-6-4-14(5-7-15)18-8-10-19(11-9-18)17(26)13-2-1-3-16(12-13)21(24)25/h1-7,12H,8-11H2