2-(4-fluorophenyl)-7,8-dimethyl-4-(4-methylpiperazin-1-yl)-3H-1,5-benzodiazepine

Systemtic Name: 2-(4-fluorophenyl)-7,8-dimethyl-4-(4-methylpiperazin-1-yl)-3H-1,5-benzodiazepine Openeye Name: 2-(4-fluorophenyl)-7,8-dimethyl-4-(4-methylpiperazin-1-yl)-3H-1,5-benzodiazepine CAS Name: 2-(4-fluorophenyl)-7,8-dimethyl-4-(4-methyl-1-piperazinyl)-3H-1,5-benzodiazepine IUPAC Name: 2-(4-fluorophenyl)-7,8-dimethyl-4-(4-methylpiperazin-1-yl)-3H-1,5-benzodiazepine Traditional Name: 2-(4-fluorophenyl)-7,8-dimethyl-4-(4-methylpiperazino)-3H-1,5-benzodiazepine Formula: C22H25FN4 MolecularWeight: 364.459103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(CC(=N2)C3=CC=C(C=C3)F)N4CCN(CC4)C

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(CC(=N2)C3=CC=C(C=C3)F)N4CCN(CC4)C

InChI

InChI=1S/C22H25FN4/c1-15-12-20-21(13-16(15)2)25-22(27-10-8-26(3)9-11-27)14-19(24-20)17-4-6-18(23)7-5-17/h4-7,12-13H,8-11,14H2,1-3H3