N-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]methyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide

Systemtic Name: N-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]methyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide Openeye Name: N-[[6-(2,5-dimethylphenoxy)-3-pyridyl]methyl]-4-oxo-4-(2-thienyl)butanamide CAS Name: N-[[6-(2,5-dimethylphenoxy)-3-pyridinyl]methyl]-4-oxo-4-thiophen-2-ylbutanamide IUPAC Name: N-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]methyl]-4-oxo-4-thiophen-2-ylbutanamide Traditional Name: N-[[6-(2,5-dimethylphenoxy)-3-pyridyl]methyl]-4-keto-4-(2-thienyl)butyramide Formula: C22H22N2O3S MolecularWeight: 394.48668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=NC=C(C=C2)CNC(=O)CCC(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=NC=C(C=C2)CNC(=O)CCC(=O)C3=CC=CS3

InChI

InChI=1S/C22H22N2O3S/c1-15-5-6-16(2)19(12-15)27-22-10-7-17(14-24-22)13-23-21(26)9-8-18(25)20-4-3-11-28-20/h3-7,10-12,14H,8-9,13H2,1-2H3,(H,23,26)