(4-methylphenyl)methyl 4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanoate

Systemtic Name: (4-methylphenyl)methyl 4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanoate Openeye Name: p-tolylmethyl 4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanoate CAS Name: 4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]butanoic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl 4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanoate Traditional Name: 4-(methylthio)-2-[(2-phenoxyacetyl)amino]butyric acid (4-methylbenzyl) ester Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)C(CCSC)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)C(CCSC)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C21H25NO4S/c1-16-8-10-17(11-9-16)14-26-21(24)19(12-13-27-2)22-20(23)15-25-18-6-4-3-5-7-18/h3-11,19H,12-15H2,1-2H3,(H,22,23)