[(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] (2R)-3-methyl-2-(thiophen-2-ylcarbonylamino)butanoate

Systemtic Name: [(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] (2R)-3-methyl-2-(thiophen-2-ylcarbonylamino)butanoate Openeye Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] (2R)-3-methyl-2-(thiophene-2-carbonylamino)butanoate CAS Name: (2R)-3-methyl-2-[[oxo(thiophen-2-yl)methyl]amino]butanoic acid [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] (2R)-3-methyl-2-(thiophene-2-carbonylamino)butanoate Traditional Name: (2R)-3-methyl-2-(2-thenoylamino)butyric acid [(1R)-2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C1=CC=CC=C1)C(=O)NC2CC2)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)[C@H](C(=O)O[C@H](C1=CC=CC=C1)C(=O)NC2CC2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C21H24N2O4S/c1-13(2)17(23-19(24)16-9-6-12-28-16)21(26)27-18(14-7-4-3-5-8-14)20(25)22-15-10-11-15/h3-9,12-13,15,17-18H,10-11H2,1-2H3,(H,22,25)(H,23,24)/t17-,18-/m1/s1