ethyl 4-methyl-2-(4-morpholin-4-yl-3-nitro-phenyl)-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-(4-morpholin-4-yl-3-nitro-phenyl)-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-(4-morpholino-3-nitro-phenyl)thiazole-5-carboxylate CAS Name: 4-methyl-2-[4-(4-morpholinyl)-3-nitrophenyl]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-(4-morpholin-4-yl-3-nitrophenyl)-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-(4-morpholino-3-nitro-phenyl)thiazole-5-carboxylic acid ethyl ester Formula: C17H19N3O5S MolecularWeight: 377.41486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])C

InChI

InChI=1S/C17H19N3O5S/c1-3-25-17(21)15-11(2)18-16(26-15)12-4-5-13(14(10-12)20(22)23)19-6-8-24-9-7-19/h4-5,10H,3,6-9H2,1-2H3