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

Systemtic Name: 1-(3-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-phenyl-piperazine Openeye Name: 1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-phenyl-piperazine CAS Name: 1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-phenylpiperazine IUPAC Name: 1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-phenylpiperazine Traditional Name: 1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-phenyl-piperazine Formula: C24H23ClN2S MolecularWeight: 406.97082

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2CC3=CC=CC=C3SC4=C2C=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2CC3=CC=CC=C3SC4=C2C=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C24H23ClN2S/c25-19-10-11-24-21(17-19)22(16-18-6-4-5-9-23(18)28-24)27-14-12-26(13-15-27)20-7-2-1-3-8-20/h1-11,17,22H,12-16H2