[(2R)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 2-(4-methylquinolin-2-yl)sulfanylethanoate

Systemtic Name: [(2R)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 2-(4-methylquinolin-2-yl)sulfanylethanoate Openeye Name: [(1R)-1-methyl-2-oxo-2-ureido-ethyl] 2-[(4-methyl-2-quinolyl)sulfanyl]acetate CAS Name: 2-[(4-methyl-2-quinolinyl)thio]acetic acid [(2R)-1-(carbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-1-oxopropan-2-yl] 2-(4-methylquinolin-2-yl)sulfanylacetate Traditional Name: 2-[(4-methyl-2-quinolyl)thio]acetic acid [(1R)-2-keto-1-methyl-2-ureido-ethyl] ester Formula: C16H17N3O4S MolecularWeight: 347.38888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)OC(C)C(=O)NC(=O)N

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)O[C@H](C)C(=O)NC(=O)N

InChI

InChI=1S/C16H17N3O4S/c1-9-7-13(18-12-6-4-3-5-11(9)12)24-8-14(20)23-10(2)15(21)19-16(17)22/h3-7,10H,8H2,1-2H3,(H3,17,19,21,22)/t10-/m1/s1