2-[(Z)-[2-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]-4-nitro-phenolate

Systemtic Name: 2-[(Z)-[2-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]-4-nitro-phenolate Openeye Name: 4-nitro-2-[(Z)-[4-oxo-2-(p-tolylsulfonylamino)thiazol-5-ylidene]methyl]phenolate CAS Name: 2-[(Z)-[2-[(4-methylphenyl)sulfonylamino]-4-oxo-5-thiazolylidene]methyl]-4-nitrophenolate IUPAC Name: 2-[(Z)-[2-[(4-methylphenyl)sulfonylamino]-4-oxo-1,3-thiazol-5-ylidene]methyl]-4-nitrophenolate Traditional Name: 2-[(Z)-[4-keto-2-(tosylamino)-2-thiazolin-5-ylidene]methyl]-4-nitro-phenolate Formula: C17H12N3O6S2- MolecularWeight: 418.42368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=O)C(=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-])S2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=O)/C(=C/C3=C(C=CC(=C3)[N+](=O)[O-])[O-])/S2

InChI

InChI=1S/C17H13N3O6S2/c1-10-2-5-13(6-3-10)28(25,26)19-17-18-16(22)15(27-17)9-11-8-12(20(23)24)4-7-14(11)21/h2-9,21H,1H3,(H,18,19,22)/p-1/b15-9-