N,N-dimethyl-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzothiazepine-8-sulfonamide

Systemtic Name: N,N-dimethyl-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzothiazepine-8-sulfonamide Openeye Name: N,N-dimethyl-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzothiazepine-8-sulfonamide CAS Name: N,N-dimethyl-6-(4-methyl-1-piperazinyl)-8-benzo[b][1,4]benzothiazepinesulfonamide IUPAC Name: N,N-dimethyl-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzothiazepine-8-sulfonamide Traditional Name: N,N-dimethyl-6-(4-methylpiperazino)benzo[b][1,4]benzothiazepine-8-sulfonamide Formula: C20H24N4O2S2 MolecularWeight: 416.56016

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=CC=CC=C3SC4=C2C=C(C=C4)S(=O)(=O)N(C)C

Isomeric SMILES

CN1CCN(CC1)C2=NC3=CC=CC=C3SC4=C2C=C(C=C4)S(=O)(=O)N(C)C

InChI

InChI=1S/C20H24N4O2S2/c1-22(2)28(25,26)15-8-9-18-16(14-15)20(24-12-10-23(3)11-13-24)21-17-6-4-5-7-19(17)27-18/h4-9,14H,10-13H2,1-3H3