3-chloranyl-5-(4-methylpiperazin-1-yl)-5H-benzo[b][1]benzothiepin-6-one

Systemtic Name: 3-chloranyl-5-(4-methylpiperazin-1-yl)-5H-benzo[b][1]benzothiepin-6-one Openeye Name: 3-chloro-5-(4-methylpiperazin-1-yl)-5H-benzo[b][1]benzothiepin-6-one CAS Name: 3-chloro-5-(4-methyl-1-piperazinyl)-5H-benzo[b][1]benzothiepin-6-one IUPAC Name: 3-chloro-5-(4-methylpiperazin-1-yl)-5H-benzo[b][1]benzothiepin-6-one Traditional Name: 3-chloro-5-(4-methylpiperazino)-5H-benzo[b][1]benzothiepin-6-one Formula: C19H19ClN2OS MolecularWeight: 358.88496

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2C3=C(C=CC(=C3)Cl)SC4=CC=CC=C4C2=O

Isomeric SMILES

CN1CCN(CC1)C2C3=C(C=CC(=C3)Cl)SC4=CC=CC=C4C2=O

InChI

InChI=1S/C19H19ClN2OS/c1-21-8-10-22(11-9-21)18-15-12-13(20)6-7-17(15)24-16-5-3-2-4-14(16)19(18)23/h2-7,12,18H,8-11H2,1H3