1-methyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: 1-methyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: 1-methyl-N-[3-(2-oxoazepan-1-yl)propyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: 1-methyl-N-[3-(2-oxo-1-azepanyl)propyl]-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: 1-methyl-N-[3-(2-oxoazepan-1-yl)propyl]-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-[3-(2-ketoazepan-1-yl)propyl]-1-methyl-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C18H25N5O2 MolecularWeight: 343.4234

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)NCCCN2CCCCCC2=O)N3C=CC=C3

Isomeric SMILES

CN1C(=C(C=N1)C(=O)NCCCN2CCCCCC2=O)N3C=CC=C3

InChI

InChI=1S/C18H25N5O2/c1-21-18(23-11-5-6-12-23)15(14-20-21)17(25)19-9-7-13-22-10-4-2-3-8-16(22)24/h5-6,11-12,14H,2-4,7-10,13H2,1H3,(H,19,25)