1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: 1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxamide Openeye Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-6-oxo-N-(p-tolyl)pyridazine-3-carboxamide CAS Name: 1-[2-(1-azepanyl)-2-oxoethyl]-N-(4-methylphenyl)-6-oxo-3-pyridazinecarboxamide IUPAC Name: 1-[2-(azepan-1-yl)-2-oxoethyl]-N-(4-methylphenyl)-6-oxopyridazine-3-carboxamide Traditional Name: 1-[2-(azepan-1-yl)-2-keto-ethyl]-6-keto-N-(p-tolyl)pyridazine-3-carboxamide Formula: C20H24N4O3 MolecularWeight: 368.42956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)CC(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)CC(=O)N3CCCCCC3

InChI

InChI=1S/C20H24N4O3/c1-15-6-8-16(9-7-15)21-20(27)17-10-11-18(25)24(22-17)14-19(26)23-12-4-2-3-5-13-23/h6-11H,2-5,12-14H2,1H3,(H,21,27)