3-chloranyl-5-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzothiepin-8-ol

Systemtic Name: 3-chloranyl-5-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzothiepin-8-ol Openeye Name: 3-chloro-5-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzothiepin-8-ol CAS Name: 3-chloro-5-(4-methyl-1-piperazinyl)-5,6-dihydrobenzo[b][1]benzothiepin-8-ol IUPAC Name: 3-chloro-5-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzothiepin-8-ol Traditional Name: 3-chloro-5-(4-methylpiperazino)-5,6-dihydrobenzo[b][1]benzothiepin-8-ol Formula: C19H21ClN2OS MolecularWeight: 360.90084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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