1-(3-fluoranyl-8-methyl-benzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine

Systemtic Name: 1-(3-fluoranyl-8-methyl-benzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine Openeye Name: 1-(3-fluoro-8-methyl-benzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine CAS Name: 1-(3-fluoro-8-methyl-5-benzo[b][1]benzothiepinyl)-4-methylpiperazine IUPAC Name: 1-(3-fluoro-8-methylbenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine Traditional Name: 1-(3-fluoro-8-methyl-benzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine Formula: C20H21FN2S MolecularWeight: 340.457543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC3=C(C=C(C=C3)F)C(=C2)N4CCN(CC4)C

Isomeric SMILES

CC1=CC2=C(C=C1)SC3=C(C=C(C=C3)F)C(=C2)N4CCN(CC4)C

InChI

InChI=1S/C20H21FN2S/c1-14-3-5-19-15(11-14)12-18(23-9-7-22(2)8-10-23)17-13-16(21)4-6-20(17)24-19/h3-6,11-13H,7-10H2,1-2H3