2-[[1-[1-(4-methoxyphenyl)cyclopropyl]carbonylpiperidin-4-yl]methyl]-6-thiophen-2-yl-pyridazin-3-one

Systemtic Name: 2-[[1-[1-(4-methoxyphenyl)cyclopropyl]carbonylpiperidin-4-yl]methyl]-6-thiophen-2-yl-pyridazin-3-one Openeye Name: 2-[[1-[1-(4-methoxyphenyl)cyclopropanecarbonyl]-4-piperidyl]methyl]-6-(2-thienyl)pyridazin-3-one CAS Name: 2-[[1-[[1-(4-methoxyphenyl)cyclopropyl]-oxomethyl]-4-piperidinyl]methyl]-6-thiophen-2-yl-3-pyridazinone IUPAC Name: 2-[[1-[1-(4-methoxyphenyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]-6-thiophen-2-ylpyridazin-3-one Traditional Name: 2-[[1-[1-(4-methoxyphenyl)cyclopropanecarbonyl]-4-piperidyl]methyl]-6-(2-thienyl)pyridazin-3-one Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(CC2)C(=O)N3CCC(CC3)CN4C(=O)C=CC(=N4)C5=CC=CS5

Isomeric SMILES

COC1=CC=C(C=C1)C2(CC2)C(=O)N3CCC(CC3)CN4C(=O)C=CC(=N4)C5=CC=CS5

InChI

InChI=1S/C25H27N3O3S/c1-31-20-6-4-19(5-7-20)25(12-13-25)24(30)27-14-10-18(11-15-27)17-28-23(29)9-8-21(26-28)22-3-2-16-32-22/h2-9,16,18H,10-15,17H2,1H3