4,6-dimethyl-5-[3-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]-2-oxidanylidene-1H-pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-5-[3-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]-2-oxidanylidene-1H-pyridine-3-carbonitrile Openeye Name: 4,6-dimethyl-5-[3-[4-(m-tolylmethyl)piperazin-1-yl]-3-oxo-propyl]-2-oxo-1H-pyridine-3-carbonitrile CAS Name: 4,6-dimethyl-5-[3-[4-[(3-methylphenyl)methyl]-1-piperazinyl]-3-oxopropyl]-2-oxo-1H-pyridine-3-carbonitrile IUPAC Name: 4,6-dimethyl-5-[3-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-3-oxopropyl]-2-oxo-1H-pyridine-3-carbonitrile Traditional Name: 2-keto-5-[3-keto-3-[4-(3-methylbenzyl)piperazino]propyl]-4,6-dimethyl-1H-pyridine-3-carbonitrile Formula: C23H28N4O2 MolecularWeight: 392.49402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)CCC3=C(NC(=O)C(=C3C)C#N)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)CCC3=C(NC(=O)C(=C3C)C#N)C

InChI

InChI=1S/C23H28N4O2/c1-16-5-4-6-19(13-16)15-26-9-11-27(12-10-26)22(28)8-7-20-17(2)21(14-24)23(29)25-18(20)3/h4-6,13H,7-12,15H2,1-3H3,(H,25,29)