8-bromanyl-6-(4-methylpiperazin-1-yl)-5,6-dihydropyrrolo[2,1-b][1,3]benzothiazepine

Systemtic Name: 8-bromanyl-6-(4-methylpiperazin-1-yl)-5,6-dihydropyrrolo[2,1-b][1,3]benzothiazepine Openeye Name: 8-bromo-6-(4-methylpiperazin-1-yl)-5,6-dihydropyrrolo[2,1-b][1,3]benzothiazepine CAS Name: 8-bromo-6-(4-methyl-1-piperazinyl)-5,6-dihydropyrrolo[2,1-b][1,3]benzothiazepine IUPAC Name: 8-bromo-6-(4-methylpiperazin-1-yl)-5,6-dihydropyrrolo[2,1-b][1,3]benzothiazepine Traditional Name: 8-bromo-6-(4-methylpiperazino)-5,6-dihydropyrrolo[2,1-b][1,3]benzothiazepine Formula: C17H20BrN3S MolecularWeight: 378.3298

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CN3C=CC=C3SC4=C2C=C(C=C4)Br

Isomeric SMILES

CN1CCN(CC1)C2CN3C=CC=C3SC4=C2C=C(C=C4)Br

InChI

InChI=1S/C17H20BrN3S/c1-19-7-9-20(10-8-19)15-12-21-6-2-3-17(21)22-16-5-4-13(18)11-14(15)16/h2-6,11,15H,7-10,12H2,1H3