3,5-dimethyl-N-(3-methyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)-1H-pyrazole-4-sulfonamide

Systemtic Name: 3,5-dimethyl-N-(3-methyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)-1H-pyrazole-4-sulfonamide Openeye Name: 3,5-dimethyl-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-1H-pyrazole-4-sulfonamide CAS Name: 3,5-dimethyl-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-1H-pyrazole-4-sulfonamide IUPAC Name: 3,5-dimethyl-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-1H-pyrazole-4-sulfonamide Traditional Name: N-(6-keto-3-methyl-5H-benzo[b][1,4]benzoxazepin-8-yl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NS(=O)(=O)C4=C(NN=C4C)C)C(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NS(=O)(=O)C4=C(NN=C4C)C)C(=O)N2

InChI

InChI=1S/C19H18N4O4S/c1-10-4-6-17-15(8-10)20-19(24)14-9-13(5-7-16(14)27-17)23-28(25,26)18-11(2)21-22-12(18)3/h4-9,23H,1-3H3,(H,20,24)(H,21,22)