(2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl) 2-azanyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl) 2-azanyl-1,3-benzothiazole-6-carboxylate Openeye Name: (2-morpholino-2-oxo-1-phenyl-ethyl) 2-amino-1,3-benzothiazole-6-carboxylate CAS Name: 2-amino-1,3-benzothiazole-6-carboxylic acid [2-(4-morpholinyl)-2-oxo-1-phenylethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxo-1-phenylethyl) 2-amino-1,3-benzothiazole-6-carboxylate Traditional Name: 2-amino-1,3-benzothiazole-6-carboxylic acid (2-keto-2-morpholino-1-phenyl-ethyl) ester Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C(C2=CC=CC=C2)OC(=O)C3=CC4=C(C=C3)N=C(S4)N

Isomeric SMILES

C1COCCN1C(=O)C(C2=CC=CC=C2)OC(=O)C3=CC4=C(C=C3)N=C(S4)N

InChI

InChI=1S/C20H19N3O4S/c21-20-22-15-7-6-14(12-16(15)28-20)19(25)27-17(13-4-2-1-3-5-13)18(24)23-8-10-26-11-9-23/h1-7,12,17H,8-11H2,(H2,21,22)