4-(2-methylpiperidin-1-yl)-N-(pyridin-3-ylmethyl)phthalazine-1-carboxamide

Systemtic Name: 4-(2-methylpiperidin-1-yl)-N-(pyridin-3-ylmethyl)phthalazine-1-carboxamide Openeye Name: 4-(2-methyl-1-piperidyl)-N-(3-pyridylmethyl)phthalazine-1-carboxamide CAS Name: 4-(2-methyl-1-piperidinyl)-N-(3-pyridinylmethyl)-1-phthalazinecarboxamide IUPAC Name: 4-(2-methylpiperidin-1-yl)-N-(pyridin-3-ylmethyl)phthalazine-1-carboxamide Traditional Name: 4-(2-methylpiperidino)-N-(3-pyridylmethyl)phthalazine-1-carboxamide Formula: C21H23N5O MolecularWeight: 361.44022

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=NN=C(C3=CC=CC=C32)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CC1CCCCN1C2=NN=C(C3=CC=CC=C32)C(=O)NCC4=CN=CC=C4

InChI

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