2-[[(2R)-1-[2-(4-methylphenyl)ethanoyl]pyrrolidin-2-yl]methyl]-6-thiophen-2-yl-pyridazin-3-one

Systemtic Name: 2-[[(2R)-1-[2-(4-methylphenyl)ethanoyl]pyrrolidin-2-yl]methyl]-6-thiophen-2-yl-pyridazin-3-one Openeye Name: 2-[[(2R)-1-[2-(p-tolyl)acetyl]pyrrolidin-2-yl]methyl]-6-(2-thienyl)pyridazin-3-one CAS Name: 2-[[(2R)-1-[2-(4-methylphenyl)-1-oxoethyl]-2-pyrrolidinyl]methyl]-6-thiophen-2-yl-3-pyridazinone IUPAC Name: 2-[[(2R)-1-[2-(4-methylphenyl)acetyl]pyrrolidin-2-yl]methyl]-6-thiophen-2-ylpyridazin-3-one Traditional Name: 2-[[(2R)-1-[2-(p-tolyl)acetyl]pyrrolidin-2-yl]methyl]-6-(2-thienyl)pyridazin-3-one Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(=O)N2CCCC2CN3C(=O)C=CC(=N3)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)CC(=O)N2CCC[C@@H]2CN3C(=O)C=CC(=N3)C4=CC=CS4

InChI

InChI=1S/C22H23N3O2S/c1-16-6-8-17(9-7-16)14-22(27)24-12-2-4-18(24)15-25-21(26)11-10-19(23-25)20-5-3-13-28-20/h3,5-11,13,18H,2,4,12,14-15H2,1H3/t18-/m1/s1