(5R)-3-chloranyl-5-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzothiepin-9-ol

Systemtic Name: (5R)-3-chloranyl-5-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzothiepin-9-ol Openeye Name: (5R)-3-chloro-5-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzothiepin-9-ol CAS Name: (5R)-3-chloro-5-(4-methyl-1-piperazinyl)-5,6-dihydrobenzo[b][1]benzothiepin-9-ol IUPAC Name: (5R)-3-chloro-5-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzothiepin-9-ol Traditional Name: (5R)-3-chloro-5-(4-methylpiperazino)-5,6-dihydrobenzo[b][1]benzothiepin-9-ol Formula: C19H21ClN2OS MolecularWeight: 360.90084

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CC3=C(C=C(C=C3)O)SC4=C2C=C(C=C4)Cl

Isomeric SMILES

CN1CCN(CC1)[C@@H]2CC3=C(C=C(C=C3)O)SC4=C2C=C(C=C4)Cl

InChI

InChI=1S/C19H21ClN2OS/c1-21-6-8-22(9-7-21)17-10-13-2-4-15(23)12-19(13)24-18-5-3-14(20)11-16(17)18/h2-5,11-12,17,23H,6-10H2,1H3/t17-/m1/s1