[(1S)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: [(1S)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Openeye Name: [(1S)-2-morpholino-2-oxo-1-phenyl-ethyl] 2-(allylamino)thiazole-4-carboxylate CAS Name: 2-(prop-2-enylamino)-4-thiazolecarboxylic acid [(1S)-2-(4-morpholinyl)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(allylamino)thiazole-4-carboxylic acid [(1S)-2-keto-2-morpholino-1-phenyl-ethyl] ester Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC(=CS1)C(=O)OC(C2=CC=CC=C2)C(=O)N3CCOCC3

Isomeric SMILES

C=CCNC1=NC(=CS1)C(=O)O[C@@H](C2=CC=CC=C2)C(=O)N3CCOCC3

InChI

InChI=1S/C19H21N3O4S/c1-2-8-20-19-21-15(13-27-19)18(24)26-16(14-6-4-3-5-7-14)17(23)22-9-11-25-12-10-22/h2-7,13,16H,1,8-12H2,(H,20,21)/t16-/m0/s1