4-nitro-2-[(Z)-[(4-propan-2-ylphenyl)carbamothioylhydrazinylidene]methyl]phenolate

Systemtic Name: 4-nitro-2-[(Z)-[(4-propan-2-ylphenyl)carbamothioylhydrazinylidene]methyl]phenolate Openeye Name: 2-[(Z)-[(4-isopropylphenyl)carbamothioylhydrazono]methyl]-4-nitro-phenolate CAS Name: 4-nitro-2-[(Z)-[[(4-propan-2-ylanilino)-sulfanylidenemethyl]hydrazinylidene]methyl]phenolate IUPAC Name: 4-nitro-2-[(Z)-[(4-propan-2-ylphenyl)carbamothioylhydrazinylidene]methyl]phenolate Traditional Name: 4-nitro-2-[(Z)-(p-cumenylthiocarbamoylhydrazono)methyl]phenolate Formula: C17H17N4O3S- MolecularWeight: 357.40688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4O3S/c1-11(2)12-3-5-14(6-4-12)19-17(25)20-18-10-13-9-15(21(23)24)7-8-16(13)22/h3-11,22H,1-2H3,(H2,19,20,25)/p-1/b18-10-