N-[3-[[(4-methylphenyl)carbonylamino]carbamoyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[3-[[(4-methylphenyl)carbonylamino]carbamoyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[3-[[(4-methylbenzoyl)amino]carbamoyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[3-[[[(4-methylphenyl)-oxomethyl]hydrazo]-oxomethyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[3-[[(4-methylbenzoyl)amino]carbamoyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[3-[(p-toluoylamino)carbamoyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C24H23N3O6S MolecularWeight: 481.52092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C24H23N3O6S/c1-16-6-8-17(9-7-16)23(28)25-26-24(29)18-4-2-5-19(14-18)27-34(30,31)20-10-11-21-22(15-20)33-13-3-12-32-21/h2,4-11,14-15,27H,3,12-13H2,1H3,(H,25,28)(H,26,29)