3-chloranyl-5-(4-methylpiperazin-1-yl)benzo[b][1]benzothiepin-9-ol

Systemtic Name: 3-chloranyl-5-(4-methylpiperazin-1-yl)benzo[b][1]benzothiepin-9-ol Openeye Name: 3-chloro-5-(4-methylpiperazin-1-yl)benzo[b][1]benzothiepin-9-ol CAS Name: 3-chloro-5-(4-methyl-1-piperazinyl)-9-benzo[b][1]benzothiepinol IUPAC Name: 3-chloro-5-(4-methylpiperazin-1-yl)benzo[b][1]benzothiepin-9-ol Traditional Name: 3-chloro-5-(4-methylpiperazino)benzo[b][1]benzothiepin-9-ol Formula: C19H19ClN2OS MolecularWeight: 358.88496

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC3=C(C=C(C=C3)O)SC4=C2C=C(C=C4)Cl

Isomeric SMILES

CN1CCN(CC1)C2=CC3=C(C=C(C=C3)O)SC4=C2C=C(C=C4)Cl

InChI

InChI=1S/C19H19ClN2OS/c1-21-6-8-22(9-7-21)17-10-13-2-4-15(23)12-19(13)24-18-5-3-14(20)11-16(17)18/h2-5,10-12,23H,6-9H2,1H3