3-[2-oxidanylidene-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]ethyl]-2H-phthalazine-1,4-dione

Systemtic Name: 3-[2-oxidanylidene-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]ethyl]-2H-phthalazine-1,4-dione Openeye Name: 3-[2-oxo-2-[(2R)-2-(2-thienyl)pyrrolidin-1-yl]ethyl]-2H-phthalazine-1,4-dione CAS Name: 3-[2-oxo-2-[(2R)-2-thiophen-2-yl-1-pyrrolidinyl]ethyl]-2H-phthalazine-1,4-dione IUPAC Name: 3-[2-oxo-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]ethyl]-2H-phthalazine-1,4-dione Traditional Name: 3-[2-keto-2-[(2R)-2-(2-thienyl)pyrrolidino]ethyl]-2H-phthalazine-1,4-quinone Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2)C4=CC=CS4

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2)C4=CC=CS4

InChI

InChI=1S/C18H17N3O3S/c22-16(20-9-3-7-14(20)15-8-4-10-25-15)11-21-18(24)13-6-2-1-5-12(13)17(23)19-21/h1-2,4-6,8,10,14H,3,7,9,11H2,(H,19,23)/t14-/m1/s1