4-[2-[2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]-2H-phthalazin-1-one

Systemtic Name: 4-[2-[2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]-2H-phthalazin-1-one Openeye Name: 4-[2-[2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-2-oxo-ethyl]-2H-phthalazin-1-one CAS Name: 4-[2-[2-(1H-benzimidazol-2-yl)-1-pyrrolidinyl]-2-oxoethyl]-2H-phthalazin-1-one IUPAC Name: 4-[2-[2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]-2H-phthalazin-1-one Traditional Name: 4-[2-[2-(1H-benzimidazol-2-yl)pyrrolidino]-2-keto-ethyl]-2H-phthalazin-1-one Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CC2=NNC(=O)C3=CC=CC=C32)C4=NC5=CC=CC=C5N4

Isomeric SMILES

C1CC(N(C1)C(=O)CC2=NNC(=O)C3=CC=CC=C32)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C21H19N5O2/c27-19(12-17-13-6-1-2-7-14(13)21(28)25-24-17)26-11-5-10-18(26)20-22-15-8-3-4-9-16(15)23-20/h1-4,6-9,18H,5,10-12H2,(H,22,23)(H,25,28)