2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-2-phenyl-2-(phenylmethylsulfanyl)ethanoic acid

Systemtic Name: 2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-2-phenyl-2-(phenylmethylsulfanyl)ethanoic acid Openeye Name: 2-benzylsulfanyl-2-[(5-methyl-2-phenyl-oxazol-4-yl)methoxy]-2-phenyl-acetic acid CAS Name: 2-[(5-methyl-2-phenyl-4-oxazolyl)methoxy]-2-phenyl-2-(phenylmethylthio)acetic acid IUPAC Name: 2-benzylsulfanyl-2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-2-phenylacetic acid Traditional Name: 2-(benzylthio)-2-[(5-methyl-2-phenyl-oxazol-4-yl)methoxy]-2-phenyl-acetic acid Formula: C26H23NO4S MolecularWeight: 445.53012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)COC(C3=CC=CC=C3)(C(=O)O)SCC4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)COC(C3=CC=CC=C3)(C(=O)O)SCC4=CC=CC=C4

InChI

InChI=1S/C26H23NO4S/c1-19-23(27-24(31-19)21-13-7-3-8-14-21)17-30-26(25(28)29,22-15-9-4-10-16-22)32-18-20-11-5-2-6-12-20/h2-16H,17-18H2,1H3,(H,28,29)