[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl 2-benzamido-4-methylsulfanyl-butanoate

Systemtic Name: [3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl 2-benzamido-4-methylsulfanyl-butanoate Openeye Name: [3-(4-methoxyphenyl)isoxazol-5-yl]methyl 2-benzamido-4-methylsulfanyl-butanoate CAS Name: 2-benzamido-4-(methylthio)butanoic acid [3-(4-methoxyphenyl)-5-isoxazolyl]methyl ester IUPAC Name: [3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl 2-benzamido-4-methylsulfanylbutanoate Traditional Name: 2-benzamido-4-(methylthio)butyric acid [3-(4-methoxyphenyl)isoxazol-5-yl]methyl ester Formula: C23H24N2O5S MolecularWeight: 440.51206

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=C2)COC(=O)C(CCSC)NC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=C2)COC(=O)C(CCSC)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H24N2O5S/c1-28-18-10-8-16(9-11-18)21-14-19(30-25-21)15-29-23(27)20(12-13-31-2)24-22(26)17-6-4-3-5-7-17/h3-11,14,20H,12-13,15H2,1-2H3,(H,24,26)