12-(4-methylpiperazin-1-yl)-[1]benzothiolo[2,3-b][1,5]benzoxazepine

Systemtic Name: 12-(4-methylpiperazin-1-yl)-[1]benzothiolo[2,3-b][1,5]benzoxazepine Openeye Name: 12-(4-methylpiperazin-1-yl)benzothiopheno[2,3-b][1,5]benzoxazepine CAS Name: 12-(4-methyl-1-piperazinyl)-[1]benzothiolo[2,3-b][1,5]benzoxazepine IUPAC Name: 12-(4-methylpiperazin-1-yl)-[1]benzothiolo[2,3-b][1,5]benzoxazepine Traditional Name: 12-(4-methylpiperazino)benzothiopheno[2,3-b][1,5]benzoxazepine Formula: C20H19N3OS MolecularWeight: 349.44936

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C5=CC=CC=C5S4

Isomeric SMILES

CN1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C5=CC=CC=C5S4

InChI

InChI=1S/C20H19N3OS/c1-22-10-12-23(13-11-22)19-18-14-6-2-5-9-17(14)25-20(18)24-16-8-4-3-7-15(16)21-19/h2-9H,10-13H2,1H3