N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-2-sulfanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Openeye Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-2-thioxo-1H-pyridine-3-carboxamide CAS Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-2-sulfanylidene-1H-pyridine-3-carboxamide IUPAC Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Traditional Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-2-thioxo-1H-pyridine-3-carboxamide Formula: C21H19N3O5S2 MolecularWeight: 457.52266

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)NC(=O)C4=CC=CNC4=S)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)NC(=O)C4=CC=CNC4=S)OC1

InChI

InChI=1S/C21H19N3O5S2/c25-20(17-3-1-10-22-21(17)30)23-14-4-6-15(7-5-14)24-31(26,27)16-8-9-18-19(13-16)29-12-2-11-28-18/h1,3-10,13,24H,2,11-12H2,(H,22,30)(H,23,25)