4-[[3-methyl-5-[(2-methyl-1H-indol-3-yl)methylidene]-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoic acid

Systemtic Name: 4-[[3-methyl-5-[(2-methyl-1H-indol-3-yl)methylidene]-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoic acid Openeye Name: 4-[[3-methyl-5-[(2-methyl-1H-indol-3-yl)methylene]-4-oxo-thiazolidin-2-ylidene]amino]benzoic acid CAS Name: 4-[[3-methyl-5-[(2-methyl-1H-indol-3-yl)methylidene]-4-oxo-2-thiazolidinylidene]amino]benzoic acid IUPAC Name: 4-[[3-methyl-5-[(2-methyl-1H-indol-3-yl)methylidene]-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoic acid Traditional Name: 4-[[4-keto-3-methyl-5-[(2-methyl-1H-indol-3-yl)methylene]thiazolidin-2-ylidene]amino]benzoic acid Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C=C3C(=O)N(C(=NC4=CC=C(C=C4)C(=O)O)S3)C

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C=C3C(=O)N(C(=NC4=CC=C(C=C4)C(=O)O)S3)C

InChI

InChI=1S/C21H17N3O3S/c1-12-16(15-5-3-4-6-17(15)22-12)11-18-19(25)24(2)21(28-18)23-14-9-7-13(8-10-14)20(26)27/h3-11,22H,1-2H3,(H,26,27)