5-[2,5-dimethyl-3-[(4-oxidanylidene-2-phenylazanyl-1,3-thiazol-5-ylidene)methyl]pyrrol-1-yl]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[2,5-dimethyl-3-[(4-oxidanylidene-2-phenylazanyl-1,3-thiazol-5-ylidene)methyl]pyrrol-1-yl]benzene-1,3-dicarboxylic acid Openeye Name: 5-[3-[(2-anilino-4-oxo-thiazol-5-ylidene)methyl]-2,5-dimethyl-pyrrol-1-yl]benzene-1,3-dicarboxylic acid CAS Name: 5-[3-[(2-anilino-4-oxo-5-thiazolylidene)methyl]-2,5-dimethyl-1-pyrrolyl]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[3-[(2-anilino-4-oxo-1,3-thiazol-5-ylidene)methyl]-2,5-dimethylpyrrol-1-yl]benzene-1,3-dicarboxylic acid Traditional Name: 5-[3-[(2-anilino-4-keto-2-thiazolin-5-ylidene)methyl]-2,5-dimethyl-pyrrol-1-yl]isophthalic acid Formula: C24H19N3O5S MolecularWeight: 461.48976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC(=C2)C(=O)O)C(=O)O)C)C=C3C(=O)N=C(S3)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC(=C2)C(=O)O)C(=O)O)C)C=C3C(=O)N=C(S3)NC4=CC=CC=C4

InChI

InChI=1S/C24H19N3O5S/c1-13-8-15(12-20-21(28)26-24(33-20)25-18-6-4-3-5-7-18)14(2)27(13)19-10-16(22(29)30)9-17(11-19)23(31)32/h3-12H,1-2H3,(H,29,30)(H,31,32)(H,25,26,28)