[(2R)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] (2S)-2-[(2-methoxyphenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: [(2R)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] (2S)-2-[(2-methoxyphenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: [(1R)-1-methyl-2-oxo-2-ureido-ethyl] (2S)-2-[(2-methoxybenzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[(2-methoxyphenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid [(2R)-1-(carbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-1-oxopropan-2-yl] (2S)-2-[(2-methoxybenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-4-(methylthio)-2-(o-anisoylamino)butyric acid [(1R)-2-keto-1-methyl-2-ureido-ethyl] ester Formula: C17H23N3O6S MolecularWeight: 397.44602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3O6S/c1-10(14(21)20-17(18)24)26-16(23)12(8-9-27-3)19-15(22)11-6-4-5-7-13(11)25-2/h4-7,10,12H,8-9H2,1-3H3,(H,19,22)(H3,18,20,21,24)/t10-,12+/m1/s1