4-[(Z)-[(2,4-dimethylphenyl)carbamothioylhydrazinylidene]methyl]-2-methoxy-6-nitro-phenolate

Systemtic Name: 4-[(Z)-[(2,4-dimethylphenyl)carbamothioylhydrazinylidene]methyl]-2-methoxy-6-nitro-phenolate Openeye Name: 4-[(Z)-[(2,4-dimethylphenyl)carbamothioylhydrazono]methyl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[(Z)-[[(2,4-dimethylanilino)-sulfanylidenemethyl]hydrazinylidene]methyl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[(Z)-[(2,4-dimethylphenyl)carbamothioylhydrazinylidene]methyl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[(Z)-[(2,4-dimethylphenyl)thiocarbamoylhydrazono]methyl]-2-methoxy-6-nitro-phenolate Formula: C17H17N4O4S- MolecularWeight: 373.40628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NN=CC2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)N/N=C\C2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C17H18N4O4S/c1-10-4-5-13(11(2)6-10)19-17(26)20-18-9-12-7-14(21(23)24)16(22)15(8-12)25-3/h4-9,22H,1-3H3,(H2,19,20,26)/p-1/b18-9-