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

Systemtic Name: 4-chloranyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide Openeye Name: 4-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-pyridylmethylsulfamoyl)benzamide CAS Name: 4-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-pyridinylmethylsulfamoyl)benzamide IUPAC Name: 4-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide Traditional Name: 4-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-pyridylmethylsulfamoyl)benzamide Formula: C22H20ClN3O5S MolecularWeight: 473.9293

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)NCC4=CN=CC=C4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)NCC4=CN=CC=C4)OC1

InChI

InChI=1S/C22H20ClN3O5S/c23-18-6-4-16(11-21(18)32(28,29)25-14-15-3-1-8-24-13-15)22(27)26-17-5-7-19-20(12-17)31-10-2-9-30-19/h1,3-8,11-13,25H,2,9-10,14H2,(H,26,27)