6-(2-fluorophenyl)-1,4,4-trimethyl-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-8-amine

Systemtic Name: 6-(2-fluorophenyl)-1,4,4-trimethyl-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-8-amine Openeye Name: 6-(2-fluorophenyl)-1,4,4-trimethyl-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-8-amine CAS Name: 6-(2-fluorophenyl)-1,4,4-trimethyl-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-8-amine IUPAC Name: 6-(2-fluorophenyl)-1,4,4-trimethyl-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-8-amine Traditional Name: [6-(2-fluorophenyl)-1,4,4-trimethyl-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-8-yl]amine Formula: C19H18FN5 MolecularWeight: 335.378123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C2N1C3=C(C=C(C=C3)N)C(=NC2(C)C)C4=CC=CC=C4F

Isomeric SMILES

CC1=NN=C2N1C3=C(C=C(C=C3)N)C(=NC2(C)C)C4=CC=CC=C4F

InChI

InChI=1S/C19H18FN5/c1-11-23-24-18-19(2,3)22-17(13-6-4-5-7-15(13)20)14-10-12(21)8-9-16(14)25(11)18/h4-10H,21H2,1-3H3