8-fluoranyl-6-piperazin-1-yl-pyrrolo[2,1-b][1,3]benzothiazepine

Systemtic Name: 8-fluoranyl-6-piperazin-1-yl-pyrrolo[2,1-b][1,3]benzothiazepine Openeye Name: 8-fluoro-6-piperazin-1-yl-pyrrolo[2,1-b][1,3]benzothiazepine CAS Name: 8-fluoro-6-(1-piperazinyl)pyrrolo[2,1-b][1,3]benzothiazepine IUPAC Name: 8-fluoro-6-piperazin-1-ylpyrrolo[2,1-b][1,3]benzothiazepine Traditional Name: 8-fluoro-6-piperazino-pyrrolo[2,1-b][1,3]benzothiazepine Formula: C16H16FN3S MolecularWeight: 301.381743

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CN3C=CC=C3SC4=C2C=C(C=C4)F

Isomeric SMILES

C1CN(CCN1)C2=CN3C=CC=C3SC4=C2C=C(C=C4)F

InChI

InChI=1S/C16H16FN3S/c17-12-3-4-15-13(10-12)14(19-8-5-18-6-9-19)11-20-7-1-2-16(20)21-15/h1-4,7,10-11,18H,5-6,8-9H2