2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[[4-(furan-2-ylcarbonylamino)phenyl]methyl]pyridine-3-carboxamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[[4-(furan-2-ylcarbonylamino)phenyl]methyl]pyridine-3-carboxamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[[4-(furan-2-carbonylamino)phenyl]methyl]pyridine-3-carboxamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-[[4-[[2-furanyl(oxo)methyl]amino]phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[[4-(furan-2-carbonylamino)phenyl]methyl]pyridine-3-carboxamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-[4-(2-furoylamino)benzyl]nicotinamide Formula: C26H21N3O5S MolecularWeight: 487.52704

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)SC3=C(C=CC=N3)C(=O)NCC4=CC=C(C=C4)NC(=O)C5=CC=CO5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)SC3=C(C=CC=N3)C(=O)NCC4=CC=C(C=C4)NC(=O)C5=CC=CO5

InChI

InChI=1S/C26H21N3O5S/c30-24(28-16-17-5-7-18(8-6-17)29-25(31)22-4-2-12-32-22)20-3-1-11-27-26(20)35-19-9-10-21-23(15-19)34-14-13-33-21/h1-12,15H,13-14,16H2,(H,28,30)(H,29,31)