methyl (2R)-2-[[4-(ethoxycarbonylamino)phenyl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[[4-(ethoxycarbonylamino)phenyl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-2-[[4-(ethoxycarbonylamino)benzoyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[[4-(ethoxycarbonylamino)phenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[4-(ethoxycarbonylamino)benzoyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[[4-(carbethoxyamino)benzoyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CCOC(=O)NC1=CC=C(C=C1)C(=O)N[C@H](CCSC)C(=O)OC

InChI

InChI=1S/C16H22N2O5S/c1-4-23-16(21)17-12-7-5-11(6-8-12)14(19)18-13(9-10-24-3)15(20)22-2/h5-8,13H,4,9-10H2,1-3H3,(H,17,21)(H,18,19)/t13-/m1/s1