(4-methylphenyl) 4-nitro-N-[[4-oxidanylidene-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino]benzenecarboximidothioate

Systemtic Name: (4-methylphenyl) 4-nitro-N-[[4-oxidanylidene-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino]benzenecarboximidothioate Openeye Name: p-tolyl N-[(3,5-diisopropyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)amino]-4-nitro-benzenecarboximidothioate CAS Name: 4-nitro-N-[[4-oxo-3,5-di(propan-2-yl)-1-cyclohexa-2,5-dienylidene]amino]benzenecarboximidothioic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 4-nitro-N-[[4-oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino]benzenecarboximidothioate Traditional Name: N-[(3,5-diisopropyl-4-keto-cyclohexa-2,5-dien-1-ylidene)amino]-4-nitro-benzenecarboximidothioic acid p-tolyl ester Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=NN=C2C=C(C(=O)C(=C2)C(C)C)C(C)C)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC(=NN=C2C=C(C(=O)C(=C2)C(C)C)C(C)C)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C26H27N3O3S/c1-16(2)23-14-20(15-24(17(3)4)25(23)30)27-28-26(33-22-12-6-18(5)7-13-22)19-8-10-21(11-9-19)29(31)32/h6-17H,1-5H3