2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]pyridine-3-carboxamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]pyridine-3-carboxamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[[2-(2-thienyl)oxazol-4-yl]methyl]pyridine-3-carboxamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-[(2-thiophen-2-yl-4-oxazolyl)methyl]-3-pyridinecarboxamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]pyridine-3-carboxamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-[[2-(2-thienyl)oxazol-4-yl]methyl]nicotinamide Formula: C22H17N3O4S2 MolecularWeight: 451.51808

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)SC3=C(C=CC=N3)C(=O)NCC4=COC(=N4)C5=CC=CS5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)SC3=C(C=CC=N3)C(=O)NCC4=COC(=N4)C5=CC=CS5

InChI

InChI=1S/C22H17N3O4S2/c26-20(24-12-14-13-29-21(25-14)19-4-2-10-30-19)16-3-1-7-23-22(16)31-15-5-6-17-18(11-15)28-9-8-27-17/h1-7,10-11,13H,8-9,12H2,(H,24,26)