6-(4-methylpiperazin-1-yl)-8-methylsulfonyl-benzo[b][1,4]benzoxazepine

Systemtic Name: 6-(4-methylpiperazin-1-yl)-8-methylsulfonyl-benzo[b][1,4]benzoxazepine Openeye Name: 6-(4-methylpiperazin-1-yl)-8-methylsulfonyl-benzo[b][1,4]benzoxazepine CAS Name: 6-(4-methyl-1-piperazinyl)-8-methylsulfonylbenzo[b][1,4]benzoxazepine IUPAC Name: 6-(4-methylpiperazin-1-yl)-8-methylsulfonylbenzo[b][1,4]benzoxazepine Traditional Name: 8-mesyl-6-(4-methylpiperazino)benzo[b][1,4]benzoxazepine Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CN1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C19H21N3O3S/c1-21-9-11-22(12-10-21)19-15-13-14(26(2,23)24)7-8-17(15)25-18-6-4-3-5-16(18)20-19/h3-8,13H,9-12H2,1-2H3