N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-6-oxidanylidene-1H-pyridazine-3-carboxamide

Systemtic Name: N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-6-oxidanylidene-1H-pyridazine-3-carboxamide Openeye Name: N-[[6-(azepan-1-yl)-3-pyridyl]methyl]-6-oxo-1H-pyridazine-3-carboxamide CAS Name: N-[[6-(1-azepanyl)-3-pyridinyl]methyl]-6-oxo-1H-pyridazine-3-carboxamide IUPAC Name: N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-6-oxo-1H-pyridazine-3-carboxamide Traditional Name: N-[[6-(azepan-1-yl)-3-pyridyl]methyl]-6-keto-1H-pyridazine-3-carboxamide Formula: C17H21N5O2 MolecularWeight: 327.38094

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC=C(C=C2)CNC(=O)C3=NNC(=O)C=C3

Isomeric SMILES

C1CCCN(CC1)C2=NC=C(C=C2)CNC(=O)C3=NNC(=O)C=C3

InChI

InChI=1S/C17H21N5O2/c23-16-8-6-14(20-21-16)17(24)19-12-13-5-7-15(18-11-13)22-9-3-1-2-4-10-22/h5-8,11H,1-4,9-10,12H2,(H,19,24)(H,21,23)