4-methoxy-N-(2-oxidanylideneazepan-3-yl)-1-phenyl-pyrazole-3-carboxamide

Systemtic Name: 4-methoxy-N-(2-oxidanylideneazepan-3-yl)-1-phenyl-pyrazole-3-carboxamide Openeye Name: 4-methoxy-N-(2-oxoazepan-3-yl)-1-phenyl-pyrazole-3-carboxamide CAS Name: 4-methoxy-N-(2-oxo-3-azepanyl)-1-phenyl-3-pyrazolecarboxamide IUPAC Name: 4-methoxy-N-(2-oxoazepan-3-yl)-1-phenylpyrazole-3-carboxamide Traditional Name: N-(2-ketoazepan-3-yl)-4-methoxy-1-phenyl-pyrazole-3-carboxamide Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)NC2CCCCNC2=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CN(N=C1C(=O)NC2CCCCNC2=O)C3=CC=CC=C3

InChI

InChI=1S/C17H20N4O3/c1-24-14-11-21(12-7-3-2-4-8-12)20-15(14)17(23)19-13-9-5-6-10-18-16(13)22/h2-4,7-8,11,13H,5-6,9-10H2,1H3,(H,18,22)(H,19,23)