2-methyl-6-phenyl-9-(trifluoromethyl)-3H-[1,2,4]triazolo[3,4-d][1,5]benzodiazepine-1,5-dione

Systemtic Name: 2-methyl-6-phenyl-9-(trifluoromethyl)-3H-[1,2,4]triazolo[3,4-d][1,5]benzodiazepine-1,5-dione Openeye Name: 2-methyl-6-phenyl-9-(trifluoromethyl)-3H-[1,2,4]triazolo[3,4-d][1,5]benzodiazepine-1,5-dione CAS Name: 2-methyl-6-phenyl-9-(trifluoromethyl)-3H-[1,2,4]triazolo[3,4-d][1,5]benzodiazepine-1,5-dione IUPAC Name: 2-methyl-6-phenyl-9-(trifluoromethyl)-3H-[1,2,4]triazolo[3,4-d][1,5]benzodiazepine-1,5-dione Traditional Name: 2-methyl-6-phenyl-9-(trifluoromethyl)-3H-[1,2,4]triazolo[3,4-d][1,5]benzodiazepine-1,5-quinone Formula: C18H13F3N4O2 MolecularWeight: 374.31663

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N2C(=CC(=O)N(C3=C2C=C(C=C3)C(F)(F)F)C4=CC=CC=C4)N1

Isomeric SMILES

CN1C(=O)N2C(=CC(=O)N(C3=C2C=C(C=C3)C(F)(F)F)C4=CC=CC=C4)N1

InChI

InChI=1S/C18H13F3N4O2/c1-23-17(27)25-14-9-11(18(19,20)21)7-8-13(14)24(12-5-3-2-4-6-12)16(26)10-15(25)22-23/h2-10,22H,1H3