methyl (2R)-2-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylamino]-2-phenyl-ethanoate

Systemtic Name: methyl (2R)-2-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylamino]-2-phenyl-ethanoate Openeye Name: methyl (2R)-2-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-2-phenyl-acetate CAS Name: (2R)-2-[[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-2-phenylacetate Traditional Name: (2R)-2-[[2-(1,3-benzoxazol-2-ylthio)acetyl]amino]-2-phenyl-acetic acid methyl ester Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)NC(=O)CSC2=NC3=CC=CC=C3O2

Isomeric SMILES

COC(=O)[C@@H](C1=CC=CC=C1)NC(=O)CSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C18H16N2O4S/c1-23-17(22)16(12-7-3-2-4-8-12)20-15(21)11-25-18-19-13-9-5-6-10-14(13)24-18/h2-10,16H,11H2,1H3,(H,20,21)/t16-/m1/s1