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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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