5-cyclopropyl-1-[2,2,2-tris(fluoranyl)ethyl]-1,4-benzodiazepin-3-amine

Systemtic Name: 5-cyclopropyl-1-[2,2,2-tris(fluoranyl)ethyl]-1,4-benzodiazepin-3-amine Openeye Name: 5-cyclopropyl-1-(2,2,2-trifluoroethyl)-1,4-benzodiazepin-3-amine CAS Name: 5-cyclopropyl-1-(2,2,2-trifluoroethyl)-1,4-benzodiazepin-3-amine IUPAC Name: 5-cyclopropyl-1-(2,2,2-trifluoroethyl)-1,4-benzodiazepin-3-amine Traditional Name: [5-cyclopropyl-1-(2,2,2-trifluoroethyl)-1,4-benzodiazepin-3-yl]amine Formula: C14H14F3N3 MolecularWeight: 281.27627

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=CN(C3=CC=CC=C32)CC(F)(F)F)N

Isomeric SMILES

C1CC1C2=NC(=CN(C3=CC=CC=C32)CC(F)(F)F)N

InChI

InChI=1S/C14H14F3N3/c15-14(16,17)8-20-7-12(18)19-13(9-5-6-9)10-3-1-2-4-11(10)20/h1-4,7,9H,5-6,8,18H2