[(2S)-1-oxidanylidene-1-(phenethylamino)propan-2-yl] 2-methyl-4-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: [(2S)-1-oxidanylidene-1-(phenethylamino)propan-2-yl] 2-methyl-4-phenyl-1,3-thiazole-5-carboxylate Openeye Name: [(1S)-1-methyl-2-oxo-2-(phenethylamino)ethyl] 2-methyl-4-phenyl-thiazole-5-carboxylate CAS Name: 2-methyl-4-phenyl-5-thiazolecarboxylic acid [(2S)-1-oxo-1-(phenethylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(phenethylamino)propan-2-yl] 2-methyl-4-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 2-methyl-4-phenyl-thiazole-5-carboxylic acid [(1S)-2-keto-1-methyl-2-(phenethylamino)ethyl] ester Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(S1)C(=O)OC(C)C(=O)NCCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=C(S1)C(=O)O[C@@H](C)C(=O)NCCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O3S/c1-15(21(25)23-14-13-17-9-5-3-6-10-17)27-22(26)20-19(24-16(2)28-20)18-11-7-4-8-12-18/h3-12,15H,13-14H2,1-2H3,(H,23,25)/t15-/m0/s1