2-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanyl-N-dibenzofuran-2-yl-pyridine-3-carboxamide

Systemtic Name: 2-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanyl-N-dibenzofuran-2-yl-pyridine-3-carboxamide Openeye Name: 2-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]sulfanyl-N-dibenzofuran-2-yl-pyridine-3-carboxamide CAS Name: 2-[[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]thio]-N-(2-dibenzofuranyl)-3-pyridinecarboxamide IUPAC Name: 2-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanyl-N-dibenzofuran-2-ylpyridine-3-carboxamide Traditional Name: 2-[[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]thio]-N-dibenzofuran-2-yl-nicotinamide Formula: C27H19N3O5S MolecularWeight: 497.52186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=C(C=CC=N3)C(=O)NC4=CC5=C(C=C4)OC6=CC=CC=C65

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=C(C=CC=N3)C(=O)NC4=CC5=C(C=C4)OC6=CC=CC=C65

InChI

InChI=1S/C27H19N3O5S/c31-25(29-17-8-10-23-24(13-17)34-15-33-23)14-36-27-19(5-3-11-28-27)26(32)30-16-7-9-22-20(12-16)18-4-1-2-6-21(18)35-22/h1-13H,14-15H2,(H,29,31)(H,30,32)