4-butoxy-11-[3-[ethyl(methyl)amino]propyl]-6H-benzo[c][1]benzothiepine-11-carboxamide

Systemtic Name: 4-butoxy-11-[3-[ethyl(methyl)amino]propyl]-6H-benzo[c][1]benzothiepine-11-carboxamide Openeye Name: 4-butoxy-11-[3-[ethyl(methyl)amino]propyl]-6H-benzo[c][1]benzothiepine-11-carboxamide CAS Name: 4-butoxy-11-[3-[ethyl(methyl)amino]propyl]-6H-benzo[c][1]benzothiepin-11-carboxamide IUPAC Name: 4-butoxy-11-[3-[ethyl(methyl)amino]propyl]-6H-benzo[c][1]benzothiepine-11-carboxamide Traditional Name: 4-butoxy-11-[3-[ethyl(methyl)amino]propyl]-6H-benzo[c][1]benzothiepin-11-carboxamide Formula: C25H34N2O2S MolecularWeight: 426.61466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC2=C1SCC3=CC=CC=C3C2(CCCN(C)CC)C(=O)N

Isomeric SMILES

CCCCOC1=CC=CC2=C1SCC3=CC=CC=C3C2(CCCN(C)CC)C(=O)N

InChI

InChI=1S/C25H34N2O2S/c1-4-6-17-29-22-14-9-13-21-23(22)30-18-19-11-7-8-12-20(19)25(21,24(26)28)15-10-16-27(3)5-2/h7-9,11-14H,4-6,10,15-18H2,1-3H3,(H2,26,28)