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

Systemtic Name: 6-(4-methoxyphenyl)-2-[(1-thiophen-2-ylcarbonylpiperidin-4-yl)methyl]pyridazin-3-one Openeye Name: 6-(4-methoxyphenyl)-2-[[1-(thiophene-2-carbonyl)-4-piperidyl]methyl]pyridazin-3-one CAS Name: 6-(4-methoxyphenyl)-2-[[1-[oxo(thiophen-2-yl)methyl]-4-piperidinyl]methyl]-3-pyridazinone IUPAC Name: 6-(4-methoxyphenyl)-2-[[1-(thiophene-2-carbonyl)piperidin-4-yl]methyl]pyridazin-3-one Traditional Name: 6-(4-methoxyphenyl)-2-[[1-(2-thenoyl)-4-piperidyl]methyl]pyridazin-3-one Formula: C22H23N3O3S MolecularWeight: 409.50132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C22H23N3O3S/c1-28-18-6-4-17(5-7-18)19-8-9-21(26)25(23-19)15-16-10-12-24(13-11-16)22(27)20-3-2-14-29-20/h2-9,14,16H,10-13,15H2,1H3