3-[3-[(3-cyclopentyl-4-oxidanylidene-2-phenylimino-1,3-thiazolidin-5-ylidene)methyl]-2,5-dimethyl-pyrrol-1-yl]benzoic acid

Systemtic Name: 3-[3-[(3-cyclopentyl-4-oxidanylidene-2-phenylimino-1,3-thiazolidin-5-ylidene)methyl]-2,5-dimethyl-pyrrol-1-yl]benzoic acid Openeye Name: 3-[3-[(3-cyclopentyl-4-oxo-2-phenylimino-thiazolidin-5-ylidene)methyl]-2,5-dimethyl-pyrrol-1-yl]benzoic acid CAS Name: 3-[3-[(3-cyclopentyl-4-oxo-2-phenylimino-5-thiazolidinylidene)methyl]-2,5-dimethyl-1-pyrrolyl]benzoic acid IUPAC Name: 3-[3-[(3-cyclopentyl-4-oxo-2-phenylimino-1,3-thiazolidin-5-ylidene)methyl]-2,5-dimethylpyrrol-1-yl]benzoic acid Traditional Name: 3-[3-[(3-cyclopentyl-4-keto-2-phenylimino-thiazolidin-5-ylidene)methyl]-2,5-dimethyl-pyrrol-1-yl]benzoic acid Formula: C28H27N3O3S MolecularWeight: 485.59728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC(=C2)C(=O)O)C)C=C3C(=O)N(C(=NC4=CC=CC=C4)S3)C5CCCC5

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC(=C2)C(=O)O)C)C=C3C(=O)N(C(=NC4=CC=CC=C4)S3)C5CCCC5

InChI

InChI=1S/C28H27N3O3S/c1-18-15-21(19(2)30(18)24-14-8-9-20(16-24)27(33)34)17-25-26(32)31(23-12-6-7-13-23)28(35-25)29-22-10-4-3-5-11-22/h3-5,8-11,14-17,23H,6-7,12-13H2,1-2H3,(H,33,34)