5-(1-methylpyrrol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: 5-(1-methylpyrrol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: 5-(1-methylpyrrol-2-yl)-N-(3-morpholinopropyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: 5-(1-methyl-2-pyrrolyl)-N-[3-(4-morpholinyl)propyl]-2-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 5-(1-methylpyrrol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 5-(1-methylpyrrol-2-yl)-N-(3-morpholinopropyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C22H26N6O4 MolecularWeight: 438.47964

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2=NN(C(=C2)C(=O)NCCCN3CCOCC3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC=C1C2=NN(C(=C2)C(=O)NCCCN3CCOCC3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H26N6O4/c1-25-9-3-7-20(25)19-16-21(22(29)23-8-4-10-26-11-13-32-14-12-26)27(24-19)17-5-2-6-18(15-17)28(30)31/h2-3,5-7,9,15-16H,4,8,10-14H2,1H3,(H,23,29)