N-[3-[(2S)-2-methylpiperidin-1-yl]propyl]-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[3-[(2S)-2-methylpiperidin-1-yl]propyl]-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-isobutyl-N-[3-[(2S)-2-methyl-1-piperidyl]propyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[3-[(2S)-2-methyl-1-piperidinyl]propyl]-3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[3-[(2S)-2-methylpiperidin-1-yl]propyl]-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-isobutyl-4-keto-N-[3-[(2S)-2-methylpiperidino]propyl]phthalazine-1-carboxamide Formula: C22H32N4O2 MolecularWeight: 384.51508

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

Isomeric SMILES

C[C@H]1CCCCN1CCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

InChI

InChI=1S/C22H32N4O2/c1-16(2)15-26-22(28)19-11-5-4-10-18(19)20(24-26)21(27)23-12-8-14-25-13-7-6-9-17(25)3/h4-5,10-11,16-17H,6-9,12-15H2,1-3H3,(H,23,27)/t17-/m0/s1