4-(4-ethylpiperazin-1-yl)-7,8-bis(fluoranyl)-2-phenyl-3H-1,5-benzodiazepine

Systemtic Name: 4-(4-ethylpiperazin-1-yl)-7,8-bis(fluoranyl)-2-phenyl-3H-1,5-benzodiazepine Openeye Name: 4-(4-ethylpiperazin-1-yl)-7,8-difluoro-2-phenyl-3H-1,5-benzodiazepine CAS Name: 4-(4-ethyl-1-piperazinyl)-7,8-difluoro-2-phenyl-3H-1,5-benzodiazepine IUPAC Name: 4-(4-ethylpiperazin-1-yl)-7,8-difluoro-2-phenyl-3H-1,5-benzodiazepine Traditional Name: 4-(4-ethylpiperazino)-7,8-difluoro-2-phenyl-3H-1,5-benzodiazepine Formula: C21H22F2N4 MolecularWeight: 368.422986

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC3=CC(=C(C=C3N=C(C2)C4=CC=CC=C4)F)F

Isomeric SMILES

CCN1CCN(CC1)C2=NC3=CC(=C(C=C3N=C(C2)C4=CC=CC=C4)F)F

InChI

InChI=1S/C21H22F2N4/c1-2-26-8-10-27(11-9-26)21-14-18(15-6-4-3-5-7-15)24-19-12-16(22)17(23)13-20(19)25-21/h3-7,12-13H,2,8-11,14H2,1H3