4-(3-azanylpropyl)-2-(cyclopropylmethyl)-6-(3-fluoranyl-4-methoxy-phenyl)pyridazin-3-one

Systemtic Name: 4-(3-azanylpropyl)-2-(cyclopropylmethyl)-6-(3-fluoranyl-4-methoxy-phenyl)pyridazin-3-one Openeye Name: 4-(3-aminopropyl)-2-(cyclopropylmethyl)-6-(3-fluoro-4-methoxy-phenyl)pyridazin-3-one CAS Name: 4-(3-aminopropyl)-2-(cyclopropylmethyl)-6-(3-fluoro-4-methoxyphenyl)-3-pyridazinone IUPAC Name: 4-(3-aminopropyl)-2-(cyclopropylmethyl)-6-(3-fluoro-4-methoxyphenyl)pyridazin-3-one Traditional Name: 4-(3-aminopropyl)-2-(cyclopropylmethyl)-6-(3-fluoro-4-methoxy-phenyl)pyridazin-3-one Formula: C18H22FN3O2 MolecularWeight: 331.384583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=O)C(=C2)CCCN)CC3CC3)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=O)C(=C2)CCCN)CC3CC3)F

InChI

InChI=1S/C18H22FN3O2/c1-24-17-7-6-13(9-15(17)19)16-10-14(3-2-8-20)18(23)22(21-16)11-12-4-5-12/h6-7,9-10,12H,2-5,8,11,20H2,1H3