2-(6,11-dihydrobenzo[c][1]benzothiepin-2-yl)-1-(4-methylpiperazin-1-yl)ethanethione

Systemtic Name: 2-(6,11-dihydrobenzo[c][1]benzothiepin-2-yl)-1-(4-methylpiperazin-1-yl)ethanethione Openeye Name: 2-(6,11-dihydrobenzo[c][1]benzothiepin-2-yl)-1-(4-methylpiperazin-1-yl)ethanethione CAS Name: 2-(6,11-dihydrobenzo[c][1]benzothiepin-2-yl)-1-(4-methyl-1-piperazinyl)ethanethione IUPAC Name: 2-(6,11-dihydrobenzo[c][1]benzothiepin-2-yl)-1-(4-methylpiperazin-1-yl)ethanethione Traditional Name: 2-(6,11-dihydrobenzo[c][1]benzothiepin-2-yl)-1-(4-methylpiperazino)ethanethione Formula: C21H24N2S2 MolecularWeight: 368.55866

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=S)CC2=CC3=C(C=C2)SCC4=CC=CC=C4C3

Isomeric SMILES

CN1CCN(CC1)C(=S)CC2=CC3=C(C=C2)SCC4=CC=CC=C4C3

InChI

InChI=1S/C21H24N2S2/c1-22-8-10-23(11-9-22)21(24)13-16-6-7-20-19(12-16)14-17-4-2-3-5-18(17)15-25-20/h2-7,12H,8-11,13-15H2,1H3