1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-(phenylmethyl)piperazine

Systemtic Name: 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine CAS Name: 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-(phenylmethyl)piperazine IUPAC Name: 1-benzyl-4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine Traditional Name: 1-benzyl-4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine Formula: C25H26N2S MolecularWeight: 386.55234

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3CC4=CC=CC=C4SC5=CC=CC=C35

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3CC4=CC=CC=C4SC5=CC=CC=C35

InChI

InChI=1S/C25H26N2S/c1-2-8-20(9-3-1)19-26-14-16-27(17-15-26)23-18-21-10-4-6-12-24(21)28-25-13-7-5-11-22(23)25/h1-13,23H,14-19H2