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

Systemtic Name: 2-[[(3R)-1-[2-(4-methylphenyl)propanoyl]piperidin-3-yl]methyl]-6-thiophen-2-yl-pyridazin-3-one Openeye Name: 2-[[(3R)-1-[2-(p-tolyl)propanoyl]-3-piperidyl]methyl]-6-(2-thienyl)pyridazin-3-one CAS Name: 2-[[(3R)-1-[2-(4-methylphenyl)-1-oxopropyl]-3-piperidinyl]methyl]-6-thiophen-2-yl-3-pyridazinone IUPAC Name: 2-[[(3R)-1-[2-(4-methylphenyl)propanoyl]piperidin-3-yl]methyl]-6-thiophen-2-ylpyridazin-3-one Traditional Name: 2-[[(3R)-1-[2-(p-tolyl)propanoyl]-3-piperidyl]methyl]-6-(2-thienyl)pyridazin-3-one Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)C(=O)N2CCCC(C2)CN3C(=O)C=CC(=N3)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)C(C)C(=O)N2CCC[C@H](C2)CN3C(=O)C=CC(=N3)C4=CC=CS4

InChI

InChI=1S/C24H27N3O2S/c1-17-7-9-20(10-8-17)18(2)24(29)26-13-3-5-19(15-26)16-27-23(28)12-11-21(25-27)22-6-4-14-30-22/h4,6-12,14,18-19H,3,5,13,15-16H2,1-2H3/t18?,19-/m1/s1