N-[(2,6-dimethylphenyl)methyl]-N-(2-imidazol-1-ylethyl)-4-pyridin-3-yl-butanamide

Systemtic Name: N-[(2,6-dimethylphenyl)methyl]-N-(2-imidazol-1-ylethyl)-4-pyridin-3-yl-butanamide Openeye Name: N-[(2,6-dimethylphenyl)methyl]-N-(2-imidazol-1-ylethyl)-4-(3-pyridyl)butanamide CAS Name: N-[(2,6-dimethylphenyl)methyl]-N-[2-(1-imidazolyl)ethyl]-4-(3-pyridinyl)butanamide IUPAC Name: N-[(2,6-dimethylphenyl)methyl]-N-(2-imidazol-1-ylethyl)-4-pyridin-3-ylbutanamide Traditional Name: N-(2,6-dimethylbenzyl)-N-(2-imidazol-1-ylethyl)-4-(3-pyridyl)butyramide Formula: C23H28N4O MolecularWeight: 376.49462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)CN(CCN2C=CN=C2)C(=O)CCCC3=CN=CC=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C)CN(CCN2C=CN=C2)C(=O)CCCC3=CN=CC=C3

InChI

InChI=1S/C23H28N4O/c1-19-6-3-7-20(2)22(19)17-27(15-14-26-13-12-25-18-26)23(28)10-4-8-21-9-5-11-24-16-21/h3,5-7,9,11-13,16,18H,4,8,10,14-15,17H2,1-2H3