3-[2-[(4,5-diphenyl-1,3-oxazol-2-yl)sulfanyl]ethanoylamino]benzoic acid

Systemtic Name: 3-[2-[(4,5-diphenyl-1,3-oxazol-2-yl)sulfanyl]ethanoylamino]benzoic acid Openeye Name: 3-[[2-(4,5-diphenyloxazol-2-yl)sulfanylacetyl]amino]benzoic acid CAS Name: 3-[[2-[(4,5-diphenyl-2-oxazolyl)thio]-1-oxoethyl]amino]benzoic acid IUPAC Name: 3-[[2-[(4,5-diphenyl-1,3-oxazol-2-yl)sulfanyl]acetyl]amino]benzoic acid Traditional Name: 3-[[2-[(4,5-diphenyloxazol-2-yl)thio]acetyl]amino]benzoic acid Formula: C24H18N2O4S MolecularWeight: 430.47572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(OC(=N2)SCC(=O)NC3=CC=CC(=C3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(OC(=N2)SCC(=O)NC3=CC=CC(=C3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C24H18N2O4S/c27-20(25-19-13-7-12-18(14-19)23(28)29)15-31-24-26-21(16-8-3-1-4-9-16)22(30-24)17-10-5-2-6-11-17/h1-14H,15H2,(H,25,27)(H,28,29)