6-piperazin-1-ylpyrrolo[2,1-b][1,3]benzothiazepine

Systemtic Name: 6-piperazin-1-ylpyrrolo[2,1-b][1,3]benzothiazepine Openeye Name: 6-piperazin-1-ylpyrrolo[2,1-b][1,3]benzothiazepine CAS Name: 6-(1-piperazinyl)pyrrolo[2,1-b][1,3]benzothiazepine IUPAC Name: 6-piperazin-1-ylpyrrolo[2,1-b][1,3]benzothiazepine Traditional Name: 6-piperazinopyrrolo[2,1-b][1,3]benzothiazepine Formula: C16H17N3S MolecularWeight: 283.39128

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CN3C=CC=C3SC4=CC=CC=C42

Isomeric SMILES

C1CN(CCN1)C2=CN3C=CC=C3SC4=CC=CC=C42

InChI

InChI=1S/C16H17N3S/c1-2-5-15-13(4-1)14(18-10-7-17-8-11-18)12-19-9-3-6-16(19)20-15/h1-6,9,12,17H,7-8,10-11H2