5-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzothiepine 11-oxide

Systemtic Name: 5-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzothiepine 11-oxide Openeye Name: 5-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzothiepine 11-oxide CAS Name: 5-(4-methyl-1-piperazinyl)-5,6-dihydrobenzo[b][1]benzothiepin 11-oxide IUPAC Name: 5-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzothiepine 11-oxide Traditional Name: 5-(4-methylpiperazino)-5,6-dihydrobenzo[b][1]benzothiepin 11-oxide Formula: C19H22N2OS MolecularWeight: 326.45578

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CC3=CC=CC=C3S(=O)C4=CC=CC=C24

Isomeric SMILES

CN1CCN(CC1)C2CC3=CC=CC=C3S(=O)C4=CC=CC=C24

InChI

InChI=1S/C19H22N2OS/c1-20-10-12-21(13-11-20)17-14-15-6-2-4-8-18(15)23(22)19-9-5-3-7-16(17)19/h2-9,17H,10-14H2,1H3