(6E)-2-[[(4-nitrophenyl)amino]-sulfanyl-methylidene]-6-(phenylmethylidene)cyclohexan-1-one

Systemtic Name: (6E)-2-[[(4-nitrophenyl)amino]-sulfanyl-methylidene]-6-(phenylmethylidene)cyclohexan-1-one Openeye Name: (2E)-2-benzylidene-6-[(4-nitroanilino)-sulfanyl-methylene]cyclohexanone CAS Name: (6E)-2-[mercapto-(4-nitroanilino)methylidene]-6-(phenylmethylene)-1-cyclohexanone IUPAC Name: (2E)-2-benzylidene-6-[(4-nitroanilino)-sulfanylmethylidene]cyclohexan-1-one Traditional Name: (2E)-2-benzal-6-[mercapto-(4-nitroanilino)methylene]cyclohexanone Formula: C20H18N2O3S MolecularWeight: 366.43352

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CC=CC=C2)C(=O)C(=C(NC3=CC=C(C=C3)[N+](=O)[O-])S)C1

Isomeric SMILES

C1C/C(=C\C2=CC=CC=C2)/C(=O)C(=C(NC3=CC=C(C=C3)[N+](=O)[O-])S)C1

InChI

InChI=1S/C20H18N2O3S/c23-19-15(13-14-5-2-1-3-6-14)7-4-8-18(19)20(26)21-16-9-11-17(12-10-16)22(24)25/h1-3,5-6,9-13,21,26H,4,7-8H2/b15-13+,20-18?