3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-pyridin-3-yl-benzamide

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-pyridin-3-yl-benzamide Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-(3-pyridyl)benzamide CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-(3-pyridinyl)benzamide IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-pyridin-3-ylbenzamide Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-(3-pyridyl)benzamide Formula: C21H19N3O5S MolecularWeight: 425.45766

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC(=C3)C(=O)NC4=CN=CC=C4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC(=C3)C(=O)NC4=CN=CC=C4)OC1

InChI

InChI=1S/C21H19N3O5S/c25-21(23-17-6-2-9-22-14-17)15-4-1-5-16(12-15)24-30(26,27)18-7-8-19-20(13-18)29-11-3-10-28-19/h1-2,4-9,12-14,24H,3,10-11H2,(H,23,25)