5-(2-fluorophenyl)-3-methyl-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine-7-carbonitrile

Systemtic Name: 5-(2-fluorophenyl)-3-methyl-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine-7-carbonitrile Openeye Name: 5-(2-fluorophenyl)-3-methyl-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine-7-carbonitrile CAS Name: 5-(2-fluorophenyl)-3-methyl-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine-7-carbonitrile IUPAC Name: 5-(2-fluorophenyl)-3-methyl-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine-7-carbonitrile Traditional Name: 5-(2-fluorophenyl)-3-methyl-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine-7-carbonitrile Formula: C18H12FN5 MolecularWeight: 317.319783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC3=C(C=C(C=C3)C#N)C(=N2)C4=CC=CC=C4F)NN1

Isomeric SMILES

CC1=C2C(=NC3=C(C=C(C=C3)C#N)C(=N2)C4=CC=CC=C4F)NN1

InChI

InChI=1S/C18H12FN5/c1-10-16-18(24-23-10)21-15-7-6-11(9-20)8-13(15)17(22-16)12-4-2-3-5-14(12)19/h2-8H,1H3,(H2,21,23,24)