(1-morpholin-4-yl-1-oxidanylidene-propan-2-yl) 2-[(phenylmethyl)amino]-1,3-thiazole-4-carboxylate

Systemtic Name: (1-morpholin-4-yl-1-oxidanylidene-propan-2-yl) 2-[(phenylmethyl)amino]-1,3-thiazole-4-carboxylate Openeye Name: (1-methyl-2-morpholino-2-oxo-ethyl) 2-(benzylamino)thiazole-4-carboxylate CAS Name: 2-[(phenylmethyl)amino]-4-thiazolecarboxylic acid [1-(4-morpholinyl)-1-oxopropan-2-yl] ester IUPAC Name: (1-morpholin-4-yl-1-oxopropan-2-yl) 2-(benzylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(benzylamino)thiazole-4-carboxylic acid (2-keto-1-methyl-2-morpholino-ethyl) ester Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCOCC1)OC(=O)C2=CSC(=N2)NCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N1CCOCC1)OC(=O)C2=CSC(=N2)NCC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O4S/c1-13(16(22)21-7-9-24-10-8-21)25-17(23)15-12-26-18(20-15)19-11-14-5-3-2-4-6-14/h2-6,12-13H,7-11H2,1H3,(H,19,20)