[2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] (2R)-2-[(4-tert-butylphenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: [2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] (2R)-2-[(4-tert-butylphenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: [2-(methylcarbamoylamino)-2-oxo-ethyl] (2R)-2-[(4-tert-butylbenzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[(4-tert-butylphenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid [2-(methylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylcarbamoylamino)-2-oxoethyl] (2R)-2-[(4-tert-butylbenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[(4-tert-butylbenzoyl)amino]-4-(methylthio)butyric acid [2-keto-2-(methylcarbamoylamino)ethyl] ester Formula: C20H29N3O5S MolecularWeight: 423.52636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)OCC(=O)NC(=O)NC

Isomeric SMILES

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

InChI

InChI=1S/C20H29N3O5S/c1-20(2,3)14-8-6-13(7-9-14)17(25)22-15(10-11-29-5)18(26)28-12-16(24)23-19(27)21-4/h6-9,15H,10-12H2,1-5H3,(H,22,25)(H2,21,23,24,27)/t15-/m1/s1