4-[5-[2-(2-phenylethanoylamino)-1,3-thiazol-4-yl]thiophen-2-yl]benzoic acid

Systemtic Name: 4-[5-[2-(2-phenylethanoylamino)-1,3-thiazol-4-yl]thiophen-2-yl]benzoic acid Openeye Name: 4-[5-[2-[(2-phenylacetyl)amino]thiazol-4-yl]-2-thienyl]benzoic acid CAS Name: 4-[5-[2-[(1-oxo-2-phenylethyl)amino]-4-thiazolyl]-2-thiophenyl]benzoic acid IUPAC Name: 4-[5-[2-[(2-phenylacetyl)amino]-1,3-thiazol-4-yl]thiophen-2-yl]benzoic acid Traditional Name: 4-[5-[2-[(2-phenylacetyl)amino]thiazol-4-yl]-2-thienyl]benzoic acid Formula: C22H16N2O3S2 MolecularWeight: 420.50404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC2=NC(=CS2)C3=CC=C(S3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NC2=NC(=CS2)C3=CC=C(S3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C22H16N2O3S2/c25-20(12-14-4-2-1-3-5-14)24-22-23-17(13-28-22)19-11-10-18(29-19)15-6-8-16(9-7-15)21(26)27/h1-11,13H,12H2,(H,26,27)(H,23,24,25)