N-[2-(4-methylpiperidin-1-yl)-2-thiophen-2-yl-ethyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-[2-(4-methylpiperidin-1-yl)-2-thiophen-2-yl-ethyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: 3-isopropyl-N-[2-(4-methyl-1-piperidyl)-2-(2-thienyl)ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-(4-methyl-1-piperidinyl)-2-thiophen-2-ylethyl]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[2-(4-methylpiperidin-1-yl)-2-thiophen-2-ylethyl]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-[2-(4-methylpiperidino)-2-(2-thienyl)ethyl]phthalazine-1-carboxamide Formula: C24H30N4O2S MolecularWeight: 438.5856

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C(C)C)C4=CC=CS4

Isomeric SMILES

CC1CCN(CC1)C(CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C(C)C)C4=CC=CS4

InChI

InChI=1S/C24H30N4O2S/c1-16(2)28-24(30)19-8-5-4-7-18(19)22(26-28)23(29)25-15-20(21-9-6-14-31-21)27-12-10-17(3)11-13-27/h4-9,14,16-17,20H,10-13,15H2,1-3H3,(H,25,29)