2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-(3-pyridylmethyl)pyridine-3-carboxamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-(3-pyridinylmethyl)-3-pyridinecarboxamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-(3-pyridylmethyl)nicotinamide Formula: C18H18N4O2S MolecularWeight: 354.42612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C18H18N4O2S/c1-12-16(13(2)24-22-12)11-25-18-15(6-4-8-20-18)17(23)21-10-14-5-3-7-19-9-14/h3-9H,10-11H2,1-2H3,(H,21,23)