2-[2-(2-methoxy-4-methyl-phenoxy)ethyl]-5-(4-methyl-1,4-diazepan-1-yl)pyridazin-3-one

Systemtic Name: 2-[2-(2-methoxy-4-methyl-phenoxy)ethyl]-5-(4-methyl-1,4-diazepan-1-yl)pyridazin-3-one Openeye Name: 2-[2-(2-methoxy-4-methyl-phenoxy)ethyl]-5-(4-methyl-1,4-diazepan-1-yl)pyridazin-3-one CAS Name: 2-[2-(2-methoxy-4-methylphenoxy)ethyl]-5-(4-methyl-1,4-diazepan-1-yl)-3-pyridazinone IUPAC Name: 2-[2-(2-methoxy-4-methylphenoxy)ethyl]-5-(4-methyl-1,4-diazepan-1-yl)pyridazin-3-one Traditional Name: 2-[2-(2-methoxy-4-methyl-phenoxy)ethyl]-5-(4-methyl-1,4-diazepan-1-yl)pyridazin-3-one Formula: C20H28N4O3 MolecularWeight: 372.46132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCN2C(=O)C=C(C=N2)N3CCCN(CC3)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1)OCCN2C(=O)C=C(C=N2)N3CCCN(CC3)C)OC

InChI

InChI=1S/C20H28N4O3/c1-16-5-6-18(19(13-16)26-3)27-12-11-24-20(25)14-17(15-21-24)23-8-4-7-22(2)9-10-23/h5-6,13-15H,4,7-12H2,1-3H3