ethyl 2-(2-morpholin-4-ylethanoylamino)-4-(3-nitrophenyl)-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-(2-morpholin-4-ylethanoylamino)-4-(3-nitrophenyl)-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(2-morpholinoacetyl)amino]-4-(3-nitrophenyl)thiazole-5-carboxylate CAS Name: 2-[[2-(4-morpholinyl)-1-oxoethyl]amino]-4-(3-nitrophenyl)-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-morpholin-4-ylacetyl)amino]-4-(3-nitrophenyl)-1,3-thiazole-5-carboxylate Traditional Name: 2-[(2-morpholinoacetyl)amino]-4-(3-nitrophenyl)thiazole-5-carboxylic acid ethyl ester Formula: C18H20N4O6S MolecularWeight: 420.4396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CN2CCOCC2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CN2CCOCC2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O6S/c1-2-28-17(24)16-15(12-4-3-5-13(10-12)22(25)26)20-18(29-16)19-14(23)11-21-6-8-27-9-7-21/h3-5,10H,2,6-9,11H2,1H3,(H,19,20,23)