2-nitro-N-[(4-piperidin-1-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 2-nitro-N-[(4-piperidin-1-ylphenyl)carbamothioyl]benzamide Openeye Name: 2-nitro-N-[[4-(1-piperidyl)phenyl]carbamothioyl]benzamide CAS Name: 2-nitro-N-[[4-(1-piperidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-nitro-N-[(4-piperidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 2-nitro-N-[(4-piperidinophenyl)thiocarbamoyl]benzamide Formula: C19H20N4O3S MolecularWeight: 384.4521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O3S/c24-18(16-6-2-3-7-17(16)23(25)26)21-19(27)20-14-8-10-15(11-9-14)22-12-4-1-5-13-22/h2-3,6-11H,1,4-5,12-13H2,(H2,20,21,24,27)