3-chloranyl-6-piperazin-1-yl-5,6-dihydrobenzo[b][1]benzothiepine 11-oxide

Systemtic Name: 3-chloranyl-6-piperazin-1-yl-5,6-dihydrobenzo[b][1]benzothiepine 11-oxide Openeye Name: 3-chloro-6-piperazin-1-yl-5,6-dihydrobenzo[b][1]benzothiepine 11-oxide CAS Name: 3-chloro-6-(1-piperazinyl)-5,6-dihydrobenzo[b][1]benzothiepin 11-oxide IUPAC Name: 3-chloro-6-piperazin-1-yl-5,6-dihydrobenzo[b][1]benzothiepine 11-oxide Traditional Name: 3-chloro-6-piperazino-5,6-dihydrobenzo[b][1]benzothiepin 11-oxide Formula: C18H19ClN2OS MolecularWeight: 346.87426

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2CC3=C(C=CC(=C3)Cl)S(=O)C4=CC=CC=C24

Isomeric SMILES

C1CN(CCN1)C2CC3=C(C=CC(=C3)Cl)S(=O)C4=CC=CC=C24

InChI

InChI=1S/C18H19ClN2OS/c19-14-5-6-17-13(11-14)12-16(21-9-7-20-8-10-21)15-3-1-2-4-18(15)23(17)22/h1-6,11,16,20H,7-10,12H2