N-cyclopropyl-4-methyl-3-[1-[(2R)-2-methylpiperidin-1-yl]phthalazin-6-yl]benzamide

Systemtic Name: N-cyclopropyl-4-methyl-3-[1-[(2R)-2-methylpiperidin-1-yl]phthalazin-6-yl]benzamide Openeye Name: N-cyclopropyl-4-methyl-3-[1-[(2R)-2-methyl-1-piperidyl]phthalazin-6-yl]benzamide CAS Name: N-cyclopropyl-4-methyl-3-[1-[(2R)-2-methyl-1-piperidinyl]-6-phthalazinyl]benzamide IUPAC Name: N-cyclopropyl-4-methyl-3-[1-[(2R)-2-methylpiperidin-1-yl]phthalazin-6-yl]benzamide Traditional Name: N-cyclopropyl-4-methyl-3-[1-[(2R)-2-methylpiperidino]phthalazin-6-yl]benzamide Formula: C25H28N4O MolecularWeight: 400.51602

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=C3C=CC(=CC3=CN=N2)C4=C(C=CC(=C4)C(=O)NC5CC5)C

Isomeric SMILES

C[C@@H]1CCCCN1C2=C3C=CC(=CC3=CN=N2)C4=C(C=CC(=C4)C(=O)NC5CC5)C

InChI

InChI=1S/C25H28N4O/c1-16-6-7-19(25(30)27-21-9-10-21)14-23(16)18-8-11-22-20(13-18)15-26-28-24(22)29-12-4-3-5-17(29)2/h6-8,11,13-15,17,21H,3-5,9-10,12H2,1-2H3,(H,27,30)/t17-/m1/s1