4-azanyl-1-phenyl-8-(trifluoromethyl)-3H-1,5-benzodiazepin-2-one

Systemtic Name: 4-azanyl-1-phenyl-8-(trifluoromethyl)-3H-1,5-benzodiazepin-2-one Openeye Name: 4-amino-1-phenyl-8-(trifluoromethyl)-3H-1,5-benzodiazepin-2-one CAS Name: 4-amino-1-phenyl-8-(trifluoromethyl)-3H-1,5-benzodiazepin-2-one IUPAC Name: 4-amino-1-phenyl-8-(trifluoromethyl)-3H-1,5-benzodiazepin-2-one Traditional Name: 4-amino-1-phenyl-8-(trifluoromethyl)-3H-1,5-benzodiazepin-2-one Formula: C16H12F3N3O MolecularWeight: 319.28119

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=C(C=C(C=C2)C(F)(F)F)N(C1=O)C3=CC=CC=C3)N

Isomeric SMILES

C1C(=NC2=C(C=C(C=C2)C(F)(F)F)N(C1=O)C3=CC=CC=C3)N

InChI

InChI=1S/C16H12F3N3O/c17-16(18,19)10-6-7-12-13(8-10)22(11-4-2-1-3-5-11)15(23)9-14(20)21-12/h1-8H,9H2,(H2,20,21)