[(2R)-1-oxidanylidene-1-[(4-phenyl-1,3-thiazol-2-yl)amino]propan-2-yl] 4-ethylbenzoate

Systemtic Name: [(2R)-1-oxidanylidene-1-[(4-phenyl-1,3-thiazol-2-yl)amino]propan-2-yl] 4-ethylbenzoate Openeye Name: [(1R)-1-methyl-2-oxo-2-[(4-phenylthiazol-2-yl)amino]ethyl] 4-ethylbenzoate CAS Name: 4-ethylbenzoic acid [(2R)-1-oxo-1-[(4-phenyl-2-thiazolyl)amino]propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-[(4-phenyl-1,3-thiazol-2-yl)amino]propan-2-yl] 4-ethylbenzoate Traditional Name: 4-ethylbenzoic acid [(1R)-2-keto-1-methyl-2-[(4-phenylthiazol-2-yl)amino]ethyl] ester Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)OC(C)C(=O)NC2=NC(=CS2)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)O[C@H](C)C(=O)NC2=NC(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O3S/c1-3-15-9-11-17(12-10-15)20(25)26-14(2)19(24)23-21-22-18(13-27-21)16-7-5-4-6-8-16/h4-14H,3H2,1-2H3,(H,22,23,24)/t14-/m1/s1