3-[(4-methyl-2-phenyl-1,3-thiazol-5-yl)carbonyl]-1-(3-morpholin-4-ylpropyl)-2-(3-nitrophenyl)-4-oxidanyl-2H-pyrrol-5-one

Systemtic Name: 3-[(4-methyl-2-phenyl-1,3-thiazol-5-yl)carbonyl]-1-(3-morpholin-4-ylpropyl)-2-(3-nitrophenyl)-4-oxidanyl-2H-pyrrol-5-one Openeye Name: 4-hydroxy-3-(4-methyl-2-phenyl-thiazole-5-carbonyl)-1-(3-morpholinopropyl)-2-(3-nitrophenyl)-2H-pyrrol-5-one CAS Name: 4-hydroxy-3-[(4-methyl-2-phenyl-5-thiazolyl)-oxomethyl]-1-[3-(4-morpholinyl)propyl]-2-(3-nitrophenyl)-2H-pyrrol-5-one IUPAC Name: 4-hydroxy-3-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)-1-(3-morpholin-4-ylpropyl)-2-(3-nitrophenyl)-2H-pyrrol-5-one Traditional Name: 3-hydroxy-4-(4-methyl-2-phenyl-thiazole-5-carbonyl)-1-(3-morpholinopropyl)-5-(3-nitrophenyl)-3-pyrrolin-2-one Formula: C28H28N4O6S MolecularWeight: 548.61012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)C3=C(C(=O)N(C3C4=CC(=CC=C4)[N+](=O)[O-])CCCN5CCOCC5)O

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)C3=C(C(=O)N(C3C4=CC(=CC=C4)[N+](=O)[O-])CCCN5CCOCC5)O

InChI

InChI=1S/C28H28N4O6S/c1-18-26(39-27(29-18)19-7-3-2-4-8-19)24(33)22-23(20-9-5-10-21(17-20)32(36)37)31(28(35)25(22)34)12-6-11-30-13-15-38-16-14-30/h2-5,7-10,17,23,34H,6,11-16H2,1H3