4-(2,5-dimethylphenyl)-4-oxidanylidene-N-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]butanamide

Systemtic Name: 4-(2,5-dimethylphenyl)-4-oxidanylidene-N-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]butanamide Openeye Name: 4-(2,5-dimethylphenyl)-4-oxo-N-[(2-pyrrolidin-1-yl-4-pyridyl)methyl]butanamide CAS Name: 4-(2,5-dimethylphenyl)-4-oxo-N-[[2-(1-pyrrolidinyl)-4-pyridinyl]methyl]butanamide IUPAC Name: 4-(2,5-dimethylphenyl)-4-oxo-N-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]butanamide Traditional Name: 4-(2,5-dimethylphenyl)-4-keto-N-[(2-pyrrolidino-4-pyridyl)methyl]butyramide Formula: C22H27N3O2 MolecularWeight: 365.46868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)CCC(=O)NCC2=CC(=NC=C2)N3CCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)CCC(=O)NCC2=CC(=NC=C2)N3CCCC3

InChI

InChI=1S/C22H27N3O2/c1-16-5-6-17(2)19(13-16)20(26)7-8-22(27)24-15-18-9-10-23-21(14-18)25-11-3-4-12-25/h5-6,9-10,13-14H,3-4,7-8,11-12,15H2,1-2H3,(H,24,27)