[(2R)-1-(cyclohexylcarbamoylamino)-1-oxidanylidene-propan-2-yl] (2S)-2-(furan-2-ylcarbonylamino)-4-methylsulfanyl-butanoate

Systemtic Name: [(2R)-1-(cyclohexylcarbamoylamino)-1-oxidanylidene-propan-2-yl] (2S)-2-(furan-2-ylcarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: [(1R)-2-(cyclohexylcarbamoylamino)-1-methyl-2-oxo-ethyl] (2S)-2-(furan-2-carbonylamino)-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[2-furanyl(oxo)methyl]amino]-4-(methylthio)butanoic acid [(2R)-1-[[(cyclohexylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclohexylcarbamoylamino)-1-oxopropan-2-yl] (2S)-2-(furan-2-carbonylamino)-4-methylsulfanylbutanoate Traditional Name: (2S)-2-(2-furoylamino)-4-(methylthio)butyric acid [(1R)-2-(cyclohexylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H29N3O6S MolecularWeight: 439.52576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CCCCC1)OC(=O)C(CCSC)NC(=O)C2=CC=CO2

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC1CCCCC1)OC(=O)[C@H](CCSC)NC(=O)C2=CC=CO2

InChI

InChI=1S/C20H29N3O6S/c1-13(17(24)23-20(27)21-14-7-4-3-5-8-14)29-19(26)15(10-12-30-2)22-18(25)16-9-6-11-28-16/h6,9,11,13-15H,3-5,7-8,10,12H2,1-2H3,(H,22,25)(H2,21,23,24,27)/t13-,15+/m1/s1