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

Systemtic Name: 1-[3,9-bis(chloranyl)-5,6-dihydrobenzo[b][1]benzothiepin-6-yl]-4-methyl-piperazine Openeye Name: 1-(3,9-dichloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-methyl-piperazine CAS Name: 1-(3,9-dichloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-methylpiperazine IUPAC Name: 1-(3,9-dichloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-methylpiperazine Traditional Name: 1-(3,9-dichloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-methyl-piperazine Formula: C19H20Cl2N2S MolecularWeight: 379.3465

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CC3=C(C=CC(=C3)Cl)SC4=C2C=CC(=C4)Cl

Isomeric SMILES

CN1CCN(CC1)C2CC3=C(C=CC(=C3)Cl)SC4=C2C=CC(=C4)Cl

InChI

InChI=1S/C19H20Cl2N2S/c1-22-6-8-23(9-7-22)17-11-13-10-14(20)3-5-18(13)24-19-12-15(21)2-4-16(17)19/h2-5,10,12,17H,6-9,11H2,1H3