4-[(3-butyl-4-oxidanylidene-2-phenylimino-1,3-thiazolidin-5-ylidene)methyl]benzoic acid

Systemtic Name: 4-[(3-butyl-4-oxidanylidene-2-phenylimino-1,3-thiazolidin-5-ylidene)methyl]benzoic acid Openeye Name: 4-[(3-butyl-4-oxo-2-phenylimino-thiazolidin-5-ylidene)methyl]benzoic acid CAS Name: 4-[(3-butyl-4-oxo-2-phenylimino-5-thiazolidinylidene)methyl]benzoic acid IUPAC Name: 4-[(3-butyl-4-oxo-2-phenylimino-1,3-thiazolidin-5-ylidene)methyl]benzoic acid Traditional Name: 4-[(3-butyl-4-keto-2-phenylimino-thiazolidin-5-ylidene)methyl]benzoic acid Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CC2=CC=C(C=C2)C(=O)O)SC1=NC3=CC=CC=C3

Isomeric SMILES

CCCCN1C(=O)C(=CC2=CC=C(C=C2)C(=O)O)SC1=NC3=CC=CC=C3

InChI

InChI=1S/C21H20N2O3S/c1-2-3-13-23-19(24)18(14-15-9-11-16(12-10-15)20(25)26)27-21(23)22-17-7-5-4-6-8-17/h4-12,14H,2-3,13H2,1H3,(H,25,26)