2-[1-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propanoyl]piperidin-3-yl]-6-thiophen-2-yl-pyridazin-3-one

Systemtic Name: 2-[1-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propanoyl]piperidin-3-yl]-6-thiophen-2-yl-pyridazin-3-one Openeye Name: 2-[1-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propanoyl]-3-piperidyl]-6-(2-thienyl)pyridazin-3-one CAS Name: 2-[1-[3-(3,5-dimethyl-1H-pyrazol-4-yl)-1-oxopropyl]-3-piperidinyl]-6-thiophen-2-yl-3-pyridazinone IUPAC Name: 2-[1-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propanoyl]piperidin-3-yl]-6-thiophen-2-ylpyridazin-3-one Traditional Name: 2-[1-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propanoyl]-3-piperidyl]-6-(2-thienyl)pyridazin-3-one Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CCC(=O)N2CCCC(C2)N3C(=O)C=CC(=N3)C4=CC=CS4

Isomeric SMILES

CC1=C(C(=NN1)C)CCC(=O)N2CCCC(C2)N3C(=O)C=CC(=N3)C4=CC=CS4

InChI

InChI=1S/C21H25N5O2S/c1-14-17(15(2)23-22-14)7-9-20(27)25-11-3-5-16(13-25)26-21(28)10-8-18(24-26)19-6-4-12-29-19/h4,6,8,10,12,16H,3,5,7,9,11,13H2,1-2H3,(H,22,23)