N-[[6-butyl-1-[[4-(2-cyanophenyl)phenyl]methyl]-2-oxidanylidene-pyridin-3-yl]methyl]-N-methyl-ethanamide

Systemtic Name: N-[[6-butyl-1-[[4-(2-cyanophenyl)phenyl]methyl]-2-oxidanylidene-pyridin-3-yl]methyl]-N-methyl-ethanamide Openeye Name: N-[[6-butyl-1-[[4-(2-cyanophenyl)phenyl]methyl]-2-oxo-3-pyridyl]methyl]-N-methyl-acetamide CAS Name: N-[[6-butyl-1-[[4-(2-cyanophenyl)phenyl]methyl]-2-oxo-3-pyridinyl]methyl]-N-methylacetamide IUPAC Name: N-[[6-butyl-1-[[4-(2-cyanophenyl)phenyl]methyl]-2-oxopyridin-3-yl]methyl]-N-methylacetamide Traditional Name: N-[[6-butyl-1-[4-(2-cyanophenyl)benzyl]-2-keto-3-pyridyl]methyl]-N-methyl-acetamide Formula: C27H29N3O2 MolecularWeight: 427.53806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)CN(C)C(=O)C

Isomeric SMILES

CCCCC1=CC=C(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)CN(C)C(=O)C

InChI

InChI=1S/C27H29N3O2/c1-4-5-9-25-16-15-24(19-29(3)20(2)31)27(32)30(25)18-21-11-13-22(14-12-21)26-10-7-6-8-23(26)17-28/h6-8,10-16H,4-5,9,18-19H2,1-3H3