4-(2-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)phthalazine-1-carboxamide

Systemtic Name: 4-(2-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)phthalazine-1-carboxamide Openeye Name: 4-(2-methyl-1-piperidyl)-N-(2-pyridylmethyl)phthalazine-1-carboxamide CAS Name: 4-(2-methyl-1-piperidinyl)-N-(2-pyridinylmethyl)-1-phthalazinecarboxamide IUPAC Name: 4-(2-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)phthalazine-1-carboxamide Traditional Name: 4-(2-methylpiperidino)-N-(2-pyridylmethyl)phthalazine-1-carboxamide Formula: C21H23N5O MolecularWeight: 361.44022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=NN=C(C3=CC=CC=C32)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

CC1CCCCN1C2=NN=C(C3=CC=CC=C32)C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C21H23N5O/c1-15-8-5-7-13-26(15)20-18-11-3-2-10-17(18)19(24-25-20)21(27)23-14-16-9-4-6-12-22-16/h2-4,6,9-12,15H,5,7-8,13-14H2,1H3,(H,23,27)