5,6-dimethyl-2-[[methyl-[(2-piperidin-1-ylphenyl)methyl]amino]methyl]-3-oxidanylidene-pyridazine-4-carbonitrile

Systemtic Name: 5,6-dimethyl-2-[[methyl-[(2-piperidin-1-ylphenyl)methyl]amino]methyl]-3-oxidanylidene-pyridazine-4-carbonitrile Openeye Name: 5,6-dimethyl-2-[[methyl-[[2-(1-piperidyl)phenyl]methyl]amino]methyl]-3-oxo-pyridazine-4-carbonitrile CAS Name: 5,6-dimethyl-2-[[methyl-[[2-(1-piperidinyl)phenyl]methyl]amino]methyl]-3-oxo-4-pyridazinecarbonitrile IUPAC Name: 5,6-dimethyl-2-[[methyl-[(2-piperidin-1-ylphenyl)methyl]amino]methyl]-3-oxopyridazine-4-carbonitrile Traditional Name: 3-keto-5,6-dimethyl-2-[[methyl-(2-piperidinobenzyl)amino]methyl]pyridazine-4-carbonitrile Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CN(C)CC2=CC=CC=C2N3CCCCC3)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CN(C)CC2=CC=CC=C2N3CCCCC3)C#N

InChI

InChI=1S/C21H27N5O/c1-16-17(2)23-26(21(27)19(16)13-22)15-24(3)14-18-9-5-6-10-20(18)25-11-7-4-8-12-25/h5-6,9-10H,4,7-8,11-12,14-15H2,1-3H3