1-(3-chloranyl-9-fluoranyl-benzo[b][1]benzothiepin-6-yl)-4-methyl-piperazine

Systemtic Name: 1-(3-chloranyl-9-fluoranyl-benzo[b][1]benzothiepin-6-yl)-4-methyl-piperazine Openeye Name: 1-(3-chloro-9-fluoro-benzo[b][1]benzothiepin-6-yl)-4-methyl-piperazine CAS Name: 1-(3-chloro-9-fluoro-6-benzo[b][1]benzothiepinyl)-4-methylpiperazine IUPAC Name: 1-(3-chloro-9-fluorobenzo[b][1]benzothiepin-6-yl)-4-methylpiperazine Traditional Name: 1-(3-chloro-9-fluoro-benzo[b][1]benzothiepin-6-yl)-4-methyl-piperazine Formula: C19H18ClFN2S MolecularWeight: 360.876023

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18ClFN2S/c1-22-6-8-23(9-7-22)17-11-13-10-14(20)2-5-18(13)24-19-12-15(21)3-4-16(17)19/h2-5,10-12H,6-9H2,1H3