2-ethyl-4-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]carbonyl-phthalazin-1-one

Systemtic Name: 2-ethyl-4-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]carbonyl-phthalazin-1-one Openeye Name: 2-ethyl-4-[(2S)-2-(2-thienyl)pyrrolidine-1-carbonyl]phthalazin-1-one CAS Name: 2-ethyl-4-[oxo-[(2S)-2-thiophen-2-yl-1-pyrrolidinyl]methyl]-1-phthalazinone IUPAC Name: 2-ethyl-4-[(2S)-2-thiophen-2-ylpyrrolidine-1-carbonyl]phthalazin-1-one Traditional Name: 2-ethyl-4-[(2S)-2-(2-thienyl)pyrrolidine-1-carbonyl]phthalazin-1-one Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCCC3C4=CC=CS4

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCC[C@H]3C4=CC=CS4

InChI

InChI=1S/C19H19N3O2S/c1-2-22-18(23)14-8-4-3-7-13(14)17(20-22)19(24)21-11-5-9-15(21)16-10-6-12-25-16/h3-4,6-8,10,12,15H,2,5,9,11H2,1H3/t15-/m0/s1