N-(1-oxidanylidene-2,3-dihydroinden-5-yl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(1-oxidanylidene-2,3-dihydroinden-5-yl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: N-(1-oxoindan-5-yl)-2-(4-pyridylmethylsulfanyl)pyridine-3-carboxamide CAS Name: N-(1-oxo-2,3-dihydroinden-5-yl)-2-(pyridin-4-ylmethylthio)-3-pyridinecarboxamide IUPAC Name: N-(1-oxo-2,3-dihydroinden-5-yl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(1-ketoindan-5-yl)-2-(4-pyridylmethylthio)nicotinamide Formula: C21H17N3O2S MolecularWeight: 375.44358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C2=C1C=C(C=C2)NC(=O)C3=C(N=CC=C3)SCC4=CC=NC=C4

Isomeric SMILES

C1CC(=O)C2=C1C=C(C=C2)NC(=O)C3=C(N=CC=C3)SCC4=CC=NC=C4

InChI

InChI=1S/C21H17N3O2S/c25-19-6-3-15-12-16(4-5-17(15)19)24-20(26)18-2-1-9-23-21(18)27-13-14-7-10-22-11-8-14/h1-2,4-5,7-12H,3,6,13H2,(H,24,26)