3-(2-methylpropyl)-4-oxidanylidene-N-(1-propylpiperidin-4-yl)phthalazine-1-carboxamide

Systemtic Name: 3-(2-methylpropyl)-4-oxidanylidene-N-(1-propylpiperidin-4-yl)phthalazine-1-carboxamide Openeye Name: 3-isobutyl-4-oxo-N-(1-propyl-4-piperidyl)phthalazine-1-carboxamide CAS Name: 3-(2-methylpropyl)-4-oxo-N-(1-propyl-4-piperidinyl)-1-phthalazinecarboxamide IUPAC Name: 3-(2-methylpropyl)-4-oxo-N-(1-propylpiperidin-4-yl)phthalazine-1-carboxamide Traditional Name: 3-isobutyl-4-keto-N-(1-propyl-4-piperidyl)phthalazine-1-carboxamide Formula: C21H30N4O2 MolecularWeight: 370.4885

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

Isomeric SMILES

CCCN1CCC(CC1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

InChI

InChI=1S/C21H30N4O2/c1-4-11-24-12-9-16(10-13-24)22-20(26)19-17-7-5-6-8-18(17)21(27)25(23-19)14-15(2)3/h5-8,15-16H,4,9-14H2,1-3H3,(H,22,26)