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

Systemtic Name: 6-(4-methylpiperazin-1-yl)-8-methylsulfanyl-benzo[b][1,4]benzoxazepine Openeye Name: 6-(4-methylpiperazin-1-yl)-8-methylsulfanyl-benzo[b][1,4]benzoxazepine CAS Name: 6-(4-methyl-1-piperazinyl)-8-(methylthio)benzo[b][1,4]benzoxazepine IUPAC Name: 6-(4-methylpiperazin-1-yl)-8-methylsulfanylbenzo[b][1,4]benzoxazepine Traditional Name: 6-(4-methylpiperazino)-8-(methylthio)benzo[b][1,4]benzoxazepine Formula: C19H21N3OS MolecularWeight: 339.45454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3OS/c1-21-9-11-22(12-10-21)19-15-13-14(24-2)7-8-17(15)23-18-6-4-3-5-16(18)20-19/h3-8,13H,9-12H2,1-2H3