(6Z)-6-[[(4-methylphenyl)methylamino]-sulfanyl-methylidene]-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-[[(4-methylphenyl)methylamino]-sulfanyl-methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-4-nitro-6-[(p-tolylmethylamino)-sulfanyl-methylene]cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-[mercapto-[(4-methylphenyl)methylamino]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-[[(4-methylphenyl)methylamino]-sulfanylmethylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-[mercapto-[(4-methylbenzyl)amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C15H14N2O3S MolecularWeight: 302.34826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=C2C=C(C=CC2=O)[N+](=O)[O-])S

Isomeric SMILES

CC1=CC=C(C=C1)CN/C(=C/2\C=C(C=CC2=O)[N+](=O)[O-])/S

InChI

InChI=1S/C15H14N2O3S/c1-10-2-4-11(5-3-10)9-16-15(21)13-8-12(17(19)20)6-7-14(13)18/h2-8,16,21H,9H2,1H3/b15-13-