4-chloranyl-2-nitro-6-[(Z)-[(phenylmethyl)carbamothioylhydrazinylidene]methyl]phenolate

Systemtic Name: 4-chloranyl-2-nitro-6-[(Z)-[(phenylmethyl)carbamothioylhydrazinylidene]methyl]phenolate Openeye Name: 2-[(Z)-(benzylcarbamothioylhydrazono)methyl]-4-chloro-6-nitro-phenolate CAS Name: 4-chloro-2-nitro-6-[(Z)-[[[(phenylmethyl)amino]-sulfanylidenemethyl]hydrazinylidene]methyl]phenolate IUPAC Name: 2-[(Z)-(benzylcarbamothioylhydrazinylidene)methyl]-4-chloro-6-nitrophenolate Traditional Name: 2-[(Z)-(benzylthiocarbamoylhydrazono)methyl]-4-chloro-6-nitro-phenolate Formula: C15H12ClN4O3S- MolecularWeight: 363.79878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NN=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)N/N=C\C2=CC(=CC(=C2[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C15H13ClN4O3S/c16-12-6-11(14(21)13(7-12)20(22)23)9-18-19-15(24)17-8-10-4-2-1-3-5-10/h1-7,9,21H,8H2,(H2,17,19,24)/p-1/b18-9-