2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-(4-methylphenyl)phthalazin-1-one

Systemtic Name: 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-(4-methylphenyl)phthalazin-1-one Openeye Name: 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-(p-tolyl)phthalazin-1-one CAS Name: 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-(4-methylphenyl)-1-phthalazinone IUPAC Name: 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-(4-methylphenyl)phthalazin-1-one Traditional Name: 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-(p-tolyl)phthalazin-1-one Formula: C23H21N3OS MolecularWeight: 387.49734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CN4CCC5=C(C4)C=CS5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CN4CCC5=C(C4)C=CS5

InChI

InChI=1S/C23H21N3OS/c1-16-6-8-17(9-7-16)22-19-4-2-3-5-20(19)23(27)26(24-22)15-25-12-10-21-18(14-25)11-13-28-21/h2-9,11,13H,10,12,14-15H2,1H3