N-(4-morpholin-4-ylphenyl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(4-morpholin-4-ylphenyl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: N-(4-morpholinophenyl)-2-(4-pyridylmethylsulfanyl)pyridine-3-carboxamide CAS Name: N-[4-(4-morpholinyl)phenyl]-2-(pyridin-4-ylmethylthio)-3-pyridinecarboxamide IUPAC Name: N-(4-morpholin-4-ylphenyl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(4-morpholinophenyl)-2-(4-pyridylmethylthio)nicotinamide Formula: C22H22N4O2S MolecularWeight: 406.50068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=O)C3=C(N=CC=C3)SCC4=CC=NC=C4

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=O)C3=C(N=CC=C3)SCC4=CC=NC=C4

InChI

InChI=1S/C22H22N4O2S/c27-21(25-18-3-5-19(6-4-18)26-12-14-28-15-13-26)20-2-1-9-24-22(20)29-16-17-7-10-23-11-8-17/h1-11H,12-16H2,(H,25,27)