[(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] (2S)-2-(4-chlorophenyl)sulfanylpropanoate

Systemtic Name: [(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] (2S)-2-(4-chlorophenyl)sulfanylpropanoate Openeye Name: [(1R)-1-allophanoyl-2-methyl-propyl] (2S)-2-(4-chlorophenyl)sulfanylpropanoate CAS Name: (2S)-2-[(4-chlorophenyl)thio]propanoic acid [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] (2S)-2-(4-chlorophenyl)sulfanylpropanoate Traditional Name: (2S)-2-[(4-chlorophenyl)thio]propionic acid [(1R)-1-allophanoyl-2-methyl-propyl] ester Formula: C15H19ClN2O4S MolecularWeight: 358.84036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)C(C)SC1=CC=C(C=C1)Cl

Isomeric SMILES

C[C@@H](C(=O)O[C@H](C(C)C)C(=O)NC(=O)N)SC1=CC=C(C=C1)Cl

InChI

InChI=1S/C15H19ClN2O4S/c1-8(2)12(13(19)18-15(17)21)22-14(20)9(3)23-11-6-4-10(16)5-7-11/h4-9,12H,1-3H3,(H3,17,18,19,21)/t9-,12+/m0/s1