4-(2-thiophen-2-ylpyrrolidin-1-yl)carbonyl-2H-phthalazin-1-one

Systemtic Name: 4-(2-thiophen-2-ylpyrrolidin-1-yl)carbonyl-2H-phthalazin-1-one Openeye Name: 4-[2-(2-thienyl)pyrrolidine-1-carbonyl]-2H-phthalazin-1-one CAS Name: 4-[oxo-(2-thiophen-2-yl-1-pyrrolidinyl)methyl]-2H-phthalazin-1-one IUPAC Name: 4-(2-thiophen-2-ylpyrrolidine-1-carbonyl)-2H-phthalazin-1-one Traditional Name: 4-[2-(2-thienyl)pyrrolidine-1-carbonyl]-2H-phthalazin-1-one Formula: C17H15N3O2S MolecularWeight: 325.3849

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=NNC(=O)C3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

C1CC(N(C1)C(=O)C2=NNC(=O)C3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C17H15N3O2S/c21-16-12-6-2-1-5-11(12)15(18-19-16)17(22)20-9-3-7-13(20)14-8-4-10-23-14/h1-2,4-6,8,10,13H,3,7,9H2,(H,19,21)