[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(propylamino)ethyl] 2-[(2-methylthiazol-4-yl)methoxy]benzoate CAS Name: 2-[(2-methyl-4-thiazolyl)methoxy]benzoic acid [(2S)-1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propylamino)propan-2-yl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate Traditional Name: 2-[(2-methylthiazol-4-yl)methoxy]benzoic acid [(1S)-2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=CC=CC=C1OCC2=CSC(=N2)C

Isomeric SMILES

CCCNC(=O)[C@H](C)OC(=O)C1=CC=CC=C1OCC2=CSC(=N2)C

InChI

InChI=1S/C18H22N2O4S/c1-4-9-19-17(21)12(2)24-18(22)15-7-5-6-8-16(15)23-10-14-11-25-13(3)20-14/h5-8,11-12H,4,9-10H2,1-3H3,(H,19,21)/t12-/m0/s1