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1-(3-ethoxy-9-fluoranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine

1-(3-ethoxy-9-fluoranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine

Systemtic Name:1-(3-ethoxy-9-fluoranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine
Openeye Name:1-(3-ethoxy-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine
CAS Name:1-(3-ethoxy-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine
IUPAC Name:1-(3-ethoxy-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine
Traditional Name:1-(3-ethoxy-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine
Formula: C21H25FN2OS
MolecularWeight: 372.499403
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)SC3=C(CC2N4CCN(CC4)C)C=CC(=C3)F


Isomeric SMILES

CCOC1=CC2=C(C=C1)SC3=C(CC2N4CCN(CC4)C)C=CC(=C3)F


InChI

InChI=1S/C21H25FN2OS/c1-3-25-17-6-7-20-18(14-17)19(24-10-8-23(2)9-11-24)12-15-4-5-16(22)13-21(15)26-20/h4-7,13-14,19H,3,8-12H2,1-2H3


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