N-(3-indol-1-ylpropyl)-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide

Systemtic Name: N-(3-indol-1-ylpropyl)-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-(3-indol-1-ylpropyl)-2-[(5-methylisoxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide CAS Name: N-[3-(1-indolyl)propyl]-2-[(5-methyl-3-isoxazolyl)methylthio]-3-pyridinecarboxamide IUPAC Name: N-(3-indol-1-ylpropyl)-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-(3-indol-1-ylpropyl)-2-[(5-methylisoxazol-3-yl)methylthio]nicotinamide Formula: C22H22N4O2S MolecularWeight: 406.50068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=C(C=CC=N2)C(=O)NCCCN3C=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=NO1)CSC2=C(C=CC=N2)C(=O)NCCCN3C=CC4=CC=CC=C43

InChI

InChI=1S/C22H22N4O2S/c1-16-14-18(25-28-16)15-29-22-19(7-4-10-24-22)21(27)23-11-5-12-26-13-9-17-6-2-3-8-20(17)26/h2-4,6-10,13-14H,5,11-12,15H2,1H3,(H,23,27)