1-(3-chloranyl-2-methoxy-benzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine

Systemtic Name: 1-(3-chloranyl-2-methoxy-benzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine Openeye Name: 1-(3-chloro-2-methoxy-benzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine CAS Name: 1-(3-chloro-2-methoxy-5-benzo[b][1]benzothiepinyl)-4-methylpiperazine IUPAC Name: 1-(3-chloro-2-methoxybenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine Traditional Name: 1-(3-chloro-2-methoxy-benzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine Formula: C20H21ClN2OS MolecularWeight: 372.91154

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC3=CC=CC=C3SC4=CC(=C(C=C24)Cl)OC

Isomeric SMILES

CN1CCN(CC1)C2=CC3=CC=CC=C3SC4=CC(=C(C=C24)Cl)OC

InChI

InChI=1S/C20H21ClN2OS/c1-22-7-9-23(10-8-22)17-11-14-5-3-4-6-19(14)25-20-13-18(24-2)16(21)12-15(17)20/h3-6,11-13H,7-10H2,1-2H3