N-(1-cyclopropylcarbonylpiperidin-4-yl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-(1-cyclopropylcarbonylpiperidin-4-yl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[1-(cyclopropanecarbonyl)-4-piperidyl]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[1-[cyclopropyl(oxo)methyl]-4-piperidinyl]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[1-(cyclopropanecarbonyl)-4-piperidyl]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C21H26N4O3/c1-2-11-25-21(28)17-6-4-3-5-16(17)18(23-25)19(26)22-15-9-12-24(13-10-15)20(27)14-7-8-14/h3-6,14-15H,2,7-13H2,1H3,(H,22,26)