4-oxidanylidene-3-phenyl-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-phenyl-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)phthalazine-1-carboxamide Openeye Name: 4-oxo-3-phenyl-N-[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-phenyl-N-[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-phenyl-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)phthalazine-1-carboxamide Traditional Name: 4-keto-3-phenyl-N-[2-pyrrolidino-2-(2-thienyl)ethyl]phthalazine-1-carboxamide Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C25H24N4O2S/c30-24(26-17-21(22-13-8-16-32-22)28-14-6-7-15-28)23-19-11-4-5-12-20(19)25(31)29(27-23)18-9-2-1-3-10-18/h1-5,8-13,16,21H,6-7,14-15,17H2,(H,26,30)