2-methyl-4-[2-oxidanylidene-2-(4-thiophen-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]phthalazin-1-one

Systemtic Name: 2-methyl-4-[2-oxidanylidene-2-(4-thiophen-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]phthalazin-1-one Openeye Name: 2-methyl-4-[2-oxo-2-[4-(2-thienyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethyl]phthalazin-1-one CAS Name: 2-methyl-4-[2-oxo-2-(4-thiophen-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-1-phthalazinone IUPAC Name: 2-methyl-4-[2-oxo-2-(4-thiophen-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]phthalazin-1-one Traditional Name: 4-[2-keto-2-[4-(2-thienyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethyl]-2-methyl-phthalazin-1-one Formula: C22H19N3O2S2 MolecularWeight: 421.53516

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)N3CCC4=C(C3C5=CC=CS5)C=CS4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)N3CCC4=C(C3C5=CC=CS5)C=CS4

InChI

InChI=1S/C22H19N3O2S2/c1-24-22(27)15-6-3-2-5-14(15)17(23-24)13-20(26)25-10-8-18-16(9-12-29-18)21(25)19-7-4-11-28-19/h2-7,9,11-12,21H,8,10,13H2,1H3