5-phenyl-7-(trifluoromethyl)-3H-1,4-benzodiazepin-2-amine

Systemtic Name: 5-phenyl-7-(trifluoromethyl)-3H-1,4-benzodiazepin-2-amine Openeye Name: 5-phenyl-7-(trifluoromethyl)-3H-1,4-benzodiazepin-2-amine CAS Name: 5-phenyl-7-(trifluoromethyl)-3H-1,4-benzodiazepin-2-amine IUPAC Name: 5-phenyl-7-(trifluoromethyl)-3H-1,4-benzodiazepin-2-amine Traditional Name: [5-phenyl-7-(trifluoromethyl)-3H-1,4-benzodiazepin-2-yl]amine Formula: C16H12F3N3 MolecularWeight: 303.28179

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=C(C=C(C=C2)C(F)(F)F)C(=N1)C3=CC=CC=C3)N

Isomeric SMILES

C1C(=NC2=C(C=C(C=C2)C(F)(F)F)C(=N1)C3=CC=CC=C3)N

InChI

InChI=1S/C16H12F3N3/c17-16(18,19)11-6-7-13-12(8-11)15(21-9-14(20)22-13)10-4-2-1-3-5-10/h1-8H,9H2,(H2,20,22)