methyl (2R)-2-[[(2S)-2-[(2-methoxyphenyl)carbonylamino]-3-methyl-butanoyl]amino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[[(2S)-2-[(2-methoxyphenyl)carbonylamino]-3-methyl-butanoyl]amino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-2-[[(2S)-2-[(2-methoxybenzoyl)amino]-3-methyl-butanoyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[(2S)-2-[[(2-methoxyphenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[(2S)-2-[(2-methoxybenzoyl)amino]-3-methylbutanoyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[[(2S)-3-methyl-2-(o-anisoylamino)butanoyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C19H28N2O5S MolecularWeight: 396.50102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CCSC)C(=O)OC)NC(=O)C1=CC=CC=C1OC

Isomeric SMILES

CC(C)[C@@H](C(=O)N[C@H](CCSC)C(=O)OC)NC(=O)C1=CC=CC=C1OC

InChI

InChI=1S/C19H28N2O5S/c1-12(2)16(18(23)20-14(10-11-27-5)19(24)26-4)21-17(22)13-8-6-7-9-15(13)25-3/h6-9,12,14,16H,10-11H2,1-5H3,(H,20,23)(H,21,22)/t14-,16+/m1/s1