N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-2-phenyl-quinoline-4-carbohydrazide

Systemtic Name: N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-2-phenyl-quinoline-4-carbohydrazide Openeye Name: N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-2-phenyl-quinoline-4-carbohydrazide CAS Name: N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-2-phenyl-4-quinolinecarbohydrazide IUPAC Name: N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-2-phenylquinoline-4-carbohydrazide Traditional Name: N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-2-phenyl-cinchoninohydrazide Formula: C25H21N3O5S MolecularWeight: 475.51634

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5)OC1

InChI

InChI=1S/C25H21N3O5S/c29-25(27-28-34(30,31)18-11-12-23-24(15-18)33-14-6-13-32-23)20-16-22(17-7-2-1-3-8-17)26-21-10-5-4-9-19(20)21/h1-5,7-12,15-16,28H,6,13-14H2,(H,27,29)