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

Systemtic Name: 3-[[3-methyl-5-[(3-methyl-4-pyrrolidin-1-yl-phenyl)methylidene]-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoic acid Openeye Name: 3-[[3-methyl-5-[(3-methyl-4-pyrrolidin-1-yl-phenyl)methylene]-4-oxo-thiazolidin-2-ylidene]amino]benzoic acid CAS Name: 3-[[3-methyl-5-[[3-methyl-4-(1-pyrrolidinyl)phenyl]methylidene]-4-oxo-2-thiazolidinylidene]amino]benzoic acid IUPAC Name: 3-[[3-methyl-5-[(3-methyl-4-pyrrolidin-1-ylphenyl)methylidene]-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoic acid Traditional Name: 3-[[4-keto-3-methyl-5-(3-methyl-4-pyrrolidino-benzylidene)thiazolidin-2-ylidene]amino]benzoic acid Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C=C2C(=O)N(C(=NC3=CC=CC(=C3)C(=O)O)S2)C)N4CCCC4

Isomeric SMILES

CC1=C(C=CC(=C1)C=C2C(=O)N(C(=NC3=CC=CC(=C3)C(=O)O)S2)C)N4CCCC4

InChI

InChI=1S/C23H23N3O3S/c1-15-12-16(8-9-19(15)26-10-3-4-11-26)13-20-21(27)25(2)23(30-20)24-18-7-5-6-17(14-18)22(28)29/h5-9,12-14H,3-4,10-11H2,1-2H3,(H,28,29)