8-chloranyl-6-(4-methylpiperazin-1-yl)pyrrolo[2,1-b][1,3]benzothiazepine

Systemtic Name: 8-chloranyl-6-(4-methylpiperazin-1-yl)pyrrolo[2,1-b][1,3]benzothiazepine Openeye Name: 8-chloro-6-(4-methylpiperazin-1-yl)pyrrolo[2,1-b][1,3]benzothiazepine CAS Name: 8-chloro-6-(4-methyl-1-piperazinyl)pyrrolo[2,1-b][1,3]benzothiazepine IUPAC Name: 8-chloro-6-(4-methylpiperazin-1-yl)pyrrolo[2,1-b][1,3]benzothiazepine Traditional Name: 8-chloro-6-(4-methylpiperazino)pyrrolo[2,1-b][1,3]benzothiazepine Formula: C17H18ClN3S MolecularWeight: 331.86292

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CN3C=CC=C3SC4=C2C=C(C=C4)Cl

Isomeric SMILES

CN1CCN(CC1)C2=CN3C=CC=C3SC4=C2C=C(C=C4)Cl

InChI

InChI=1S/C17H18ClN3S/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/h2-6,11-12H,7-10H2,1H3