10-(4-methylpiperazin-1-yl)-5-(phenylsulfonyl)-6H-benzo[b][1,4]benzoxazepine

Systemtic Name: 10-(4-methylpiperazin-1-yl)-5-(phenylsulfonyl)-6H-benzo[b][1,4]benzoxazepine Openeye Name: 5-(benzenesulfonyl)-10-(4-methylpiperazin-1-yl)-6H-benzo[b][1,4]benzoxazepine CAS Name: 5-(benzenesulfonyl)-10-(4-methyl-1-piperazinyl)-6H-benzo[b][1,4]benzoxazepine IUPAC Name: 5-(benzenesulfonyl)-10-(4-methylpiperazin-1-yl)-6H-benzo[b][1,4]benzoxazepine Traditional Name: 5-besyl-10-(4-methylpiperazino)-6H-benzo[b][1,4]benzoxazepine Formula: C24H25N3O3S MolecularWeight: 435.5386

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=CC3=C2OC4=CC=CC=C4N(C3)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)C2=CC=CC3=C2OC4=CC=CC=C4N(C3)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C24H25N3O3S/c1-25-14-16-26(17-15-25)22-12-7-8-19-18-27(31(28,29)20-9-3-2-4-10-20)21-11-5-6-13-23(21)30-24(19)22/h2-13H,14-18H2,1H3