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

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-[2-(1H-indol-3-yl)ethyl]-2-[(5-methylisoxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide CAS Name: N-[2-(1H-indol-3-yl)ethyl]-2-[(5-methyl-3-isoxazolyl)methylthio]-3-pyridinecarboxamide IUPAC Name: N-[2-(1H-indol-3-yl)ethyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-[2-(1H-indol-3-yl)ethyl]-2-[(5-methylisoxazol-3-yl)methylthio]nicotinamide Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=C(C=CC=N2)C(=O)NCCC3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=NO1)CSC2=C(C=CC=N2)C(=O)NCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C21H20N4O2S/c1-14-11-16(25-27-14)13-28-21-18(6-4-9-23-21)20(26)22-10-8-15-12-24-19-7-3-2-5-17(15)19/h2-7,9,11-12,24H,8,10,13H2,1H3,(H,22,26)