3-[3-oxidanylidene-3-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propyl]-2H-phthalazine-1,4-dione

Systemtic Name: 3-[3-oxidanylidene-3-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propyl]-2H-phthalazine-1,4-dione Openeye Name: 3-[3-oxo-3-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propyl]-2H-phthalazine-1,4-dione CAS Name: 3-[3-oxo-3-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propyl]-2H-phthalazine-1,4-dione IUPAC Name: 3-[3-oxo-3-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propyl]-2H-phthalazine-1,4-dione Traditional Name: 3-[3-keto-3-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propyl]-2H-phthalazine-1,4-quinone Formula: C24H21N3O3S MolecularWeight: 431.50684

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=C1SC=C2)C3=CC=CC=C3)C(=O)CCN4C(=O)C5=CC=CC=C5C(=O)N4

Isomeric SMILES

C1CN(C(C2=C1SC=C2)C3=CC=CC=C3)C(=O)CCN4C(=O)C5=CC=CC=C5C(=O)N4

InChI

InChI=1S/C24H21N3O3S/c28-21(11-14-27-24(30)18-9-5-4-8-17(18)23(29)25-27)26-13-10-20-19(12-15-31-20)22(26)16-6-2-1-3-7-16/h1-9,12,15,22H,10-11,13-14H2,(H,25,29)