3-fluoranyl-6-piperazin-1-yl-11H-pyrrolo[2,1-c][1,4]benzodiazepine

Systemtic Name: 3-fluoranyl-6-piperazin-1-yl-11H-pyrrolo[2,1-c][1,4]benzodiazepine Openeye Name: 3-fluoro-6-piperazin-1-yl-11H-pyrrolo[2,1-c][1,4]benzodiazepine CAS Name: 3-fluoro-6-(1-piperazinyl)-11H-pyrrolo[2,1-c][1,4]benzodiazepine IUPAC Name: 3-fluoro-6-piperazin-1-yl-11H-pyrrolo[2,1-c][1,4]benzodiazepine Traditional Name: 3-fluoro-6-piperazino-11H-pyrrolo[2,1-c][1,4]benzodiazepine Formula: C16H17FN4 MolecularWeight: 284.331383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC3=C(CN4C2=CC=C4)C=CC(=C3)F

Isomeric SMILES

C1CN(CCN1)C2=NC3=C(CN4C2=CC=C4)C=CC(=C3)F

InChI

InChI=1S/C16H17FN4/c17-13-4-3-12-11-21-7-1-2-15(21)16(19-14(12)10-13)20-8-5-18-6-9-20/h1-4,7,10,18H,5-6,8-9,11H2