4-ethoxy-11-(3-piperidin-1-ylpropyl)-6H-benzo[c][1]benzothiepine-11-carboxamide

Systemtic Name: 4-ethoxy-11-(3-piperidin-1-ylpropyl)-6H-benzo[c][1]benzothiepine-11-carboxamide Openeye Name: 4-ethoxy-11-[3-(1-piperidyl)propyl]-6H-benzo[c][1]benzothiepine-11-carboxamide CAS Name: 4-ethoxy-11-[3-(1-piperidinyl)propyl]-6H-benzo[c][1]benzothiepin-11-carboxamide IUPAC Name: 4-ethoxy-11-(3-piperidin-1-ylpropyl)-6H-benzo[c][1]benzothiepine-11-carboxamide Traditional Name: 4-ethoxy-11-(3-piperidinopropyl)-6H-benzo[c][1]benzothiepin-11-carboxamide Formula: C25H32N2O2S MolecularWeight: 424.59878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1SCC3=CC=CC=C3C2(CCCN4CCCCC4)C(=O)N

Isomeric SMILES

CCOC1=CC=CC2=C1SCC3=CC=CC=C3C2(CCCN4CCCCC4)C(=O)N

InChI

InChI=1S/C25H32N2O2S/c1-2-29-22-13-8-12-21-23(22)30-18-19-10-4-5-11-20(19)25(21,24(26)28)14-9-17-27-15-6-3-7-16-27/h4-5,8,10-13H,2-3,6-7,9,14-18H2,1H3,(H2,26,28)