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

Systemtic Name: 12-(4-methylpiperazin-1-yl)-[1]benzothiolo[2,3-b][1,5]benzothiazepine Openeye Name: 12-(4-methylpiperazin-1-yl)benzothiopheno[2,3-b][1,5]benzothiazepine CAS Name: 12-(4-methyl-1-piperazinyl)-[1]benzothiolo[2,3-b][1,5]benzothiazepine IUPAC Name: 12-(4-methylpiperazin-1-yl)-[1]benzothiolo[2,3-b][1,5]benzothiazepine Traditional Name: 12-(4-methylpiperazino)benzothiopheno[2,3-b][1,5]benzothiazepine Formula: C20H19N3S2 MolecularWeight: 365.51496

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=CC=CC=C3SC4=C2C5=CC=CC=C5S4

Isomeric SMILES

CN1CCN(CC1)C2=NC3=CC=CC=C3SC4=C2C5=CC=CC=C5S4

InChI

InChI=1S/C20H19N3S2/c1-22-10-12-23(13-11-22)19-18-14-6-2-4-8-16(14)24-20(18)25-17-9-5-3-7-15(17)21-19/h2-9H,10-13H2,1H3