6-[(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)carbonyl]-2-(phenylmethyl)pyridazin-3-one

Systemtic Name: 6-[(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)carbonyl]-2-(phenylmethyl)pyridazin-3-one Openeye Name: 2-benzyl-6-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)pyridazin-3-one CAS Name: 6-[(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-oxomethyl]-2-(phenylmethyl)-3-pyridazinone IUPAC Name: 2-benzyl-6-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)pyridazin-3-one Traditional Name: 2-benzyl-6-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)pyridazin-3-one Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2=C(CCN1C(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4)SC=C2

Isomeric SMILES

CCC1C2=C(CCN1C(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4)SC=C2

InChI

InChI=1S/C21H21N3O2S/c1-2-18-16-11-13-27-19(16)10-12-23(18)21(26)17-8-9-20(25)24(22-17)14-15-6-4-3-5-7-15/h3-9,11,13,18H,2,10,12,14H2,1H3