3-[[5-ethyl-6-methyl-4-[(3-methylphenyl)methyl]-2-oxidanylidene-1H-pyridin-3-yl]-methyl-amino]propanenitrile

Systemtic Name: 3-[[5-ethyl-6-methyl-4-[(3-methylphenyl)methyl]-2-oxidanylidene-1H-pyridin-3-yl]-methyl-amino]propanenitrile Openeye Name: 3-[[5-ethyl-6-methyl-4-(m-tolylmethyl)-2-oxo-1H-pyridin-3-yl]-methyl-amino]propanenitrile CAS Name: 3-[[5-ethyl-6-methyl-4-[(3-methylphenyl)methyl]-2-oxo-1H-pyridin-3-yl]-methylamino]propanenitrile IUPAC Name: 3-[[5-ethyl-6-methyl-4-[(3-methylphenyl)methyl]-2-oxo-1H-pyridin-3-yl]-methylamino]propanenitrile Traditional Name: 3-[[5-ethyl-2-keto-6-methyl-4-(3-methylbenzyl)-1H-pyridin-3-yl]-methyl-amino]propionitrile Formula: C20H25N3O MolecularWeight: 323.432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=O)C(=C1CC2=CC=CC(=C2)C)N(C)CCC#N)C

Isomeric SMILES

CCC1=C(NC(=O)C(=C1CC2=CC=CC(=C2)C)N(C)CCC#N)C

InChI

InChI=1S/C20H25N3O/c1-5-17-15(3)22-20(24)19(23(4)11-7-10-21)18(17)13-16-9-6-8-14(2)12-16/h6,8-9,12H,5,7,11,13H2,1-4H3,(H,22,24)