1-(3-chloranyl-8-methyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine

Systemtic Name: 1-(3-chloranyl-8-methyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine Openeye Name: 1-(3-chloro-8-methyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine CAS Name: 1-(3-chloro-8-methyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine IUPAC Name: 1-(3-chloro-8-methyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine Traditional Name: 1-(3-chloro-8-methyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine Formula: C19H21ClN2S MolecularWeight: 344.90144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC3=C(C=C(C=C3)Cl)C(C2)N4CCNCC4

Isomeric SMILES

CC1=CC2=C(C=C1)SC3=C(C=C(C=C3)Cl)C(C2)N4CCNCC4

InChI

InChI=1S/C19H21ClN2S/c1-13-2-4-18-14(10-13)11-17(22-8-6-21-7-9-22)16-12-15(20)3-5-19(16)23-18/h2-5,10,12,17,21H,6-9,11H2,1H3