(6Z)-3-methyl-6-[[(3-nitrophenyl)methylamino]-sulfanyl-methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-3-methyl-6-[[(3-nitrophenyl)methylamino]-sulfanyl-methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-3-methyl-6-[[(3-nitrophenyl)methylamino]-sulfanyl-methylene]cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-[mercapto-[(3-nitrophenyl)methylamino]methylidene]-3-methyl-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-3-methyl-6-[[(3-nitrophenyl)methylamino]-sulfanylmethylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-[mercapto-[(3-nitrobenzyl)amino]methylene]-3-methyl-cyclohexa-2,4-dien-1-one Formula: C15H14N2O3S MolecularWeight: 302.34826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(NCC2=CC(=CC=C2)[N+](=O)[O-])S)C=C1

Isomeric SMILES

CC1=CC(=O)/C(=C(/NCC2=CC(=CC=C2)[N+](=O)[O-])\S)/C=C1

InChI

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