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

Systemtic Name: 1-(3-chloranyl-1-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine Openeye Name: 1-(3-chloro-1-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine CAS Name: 1-(3-chloro-1-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine IUPAC Name: 1-(3-chloro-1-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine Traditional Name: 1-(3-chloro-1-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine Formula: C20H23ClN2OS MolecularWeight: 374.92742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CC3=CC=CC=C3SC4=C(C=C(C=C24)Cl)OC

Isomeric SMILES

CN1CCN(CC1)C2CC3=CC=CC=C3SC4=C(C=C(C=C24)Cl)OC

InChI

InChI=1S/C20H23ClN2OS/c1-22-7-9-23(10-8-22)17-11-14-5-3-4-6-19(14)25-20-16(17)12-15(21)13-18(20)24-2/h3-6,12-13,17H,7-11H2,1-2H3