4-[(Z)-[2-(cyclopentylamino)-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]benzoic acid

Systemtic Name: 4-[(Z)-[2-(cyclopentylamino)-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]benzoic acid Openeye Name: 4-[(Z)-[2-(cyclopentylamino)-4-oxo-thiazol-5-ylidene]methyl]benzoic acid CAS Name: 4-[(Z)-[2-(cyclopentylamino)-4-oxo-5-thiazolylidene]methyl]benzoic acid IUPAC Name: 4-[(Z)-[2-(cyclopentylamino)-4-oxo-1,3-thiazol-5-ylidene]methyl]benzoic acid Traditional Name: 4-[(Z)-[2-(cyclopentylamino)-4-keto-2-thiazolin-5-ylidene]methyl]benzoic acid Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=NC(=O)C(=CC3=CC=C(C=C3)C(=O)O)S2

Isomeric SMILES

C1CCC(C1)NC2=NC(=O)/C(=C/C3=CC=C(C=C3)C(=O)O)/S2

InChI

InChI=1S/C16H16N2O3S/c19-14-13(9-10-5-7-11(8-6-10)15(20)21)22-16(18-14)17-12-3-1-2-4-12/h5-9,12H,1-4H2,(H,20,21)(H,17,18,19)/b13-9-