2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)ethanamide

Systemtic Name: 2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)ethanamide Openeye Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]acetamide CAS Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]acetamide IUPAC Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)acetamide Traditional Name: 2-(1,4-diketo-3H-phthalazin-2-yl)-N-[2-pyrrolidino-2-(2-thienyl)ethyl]acetamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2)C4=CC=CS4

Isomeric SMILES

C1CCN(C1)C(CNC(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2)C4=CC=CS4

InChI

InChI=1S/C20H22N4O3S/c25-18(13-24-20(27)15-7-2-1-6-14(15)19(26)22-24)21-12-16(17-8-5-11-28-17)23-9-3-4-10-23/h1-2,5-8,11,16H,3-4,9-10,12-13H2,(H,21,25)(H,22,26)