5,6-dimethyl-3-oxidanylidene-2-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]pyridazine-4-carbonitrile

Systemtic Name: 5,6-dimethyl-3-oxidanylidene-2-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]pyridazine-4-carbonitrile Openeye Name: 2-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]-5,6-dimethyl-3-oxo-pyridazine-4-carbonitrile CAS Name: 5,6-dimethyl-3-oxo-2-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-4-pyridazinecarbonitrile IUPAC Name: 2-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-5,6-dimethyl-3-oxopyridazine-4-carbonitrile Traditional Name: 2-[2-(4-benzylpiperidino)-2-keto-ethyl]-3-keto-5,6-dimethyl-pyridazine-4-carbonitrile Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC(=O)N2CCC(CC2)CC3=CC=CC=C3)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC(=O)N2CCC(CC2)CC3=CC=CC=C3)C#N

InChI

InChI=1S/C21H24N4O2/c1-15-16(2)23-25(21(27)19(15)13-22)14-20(26)24-10-8-18(9-11-24)12-17-6-4-3-5-7-17/h3-7,18H,8-12,14H2,1-2H3