4-(3-pyrimidin-2-ylphenyl)-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: 4-(3-pyrimidin-2-ylphenyl)-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 4-(3-pyrimidin-2-ylphenyl)-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 4-[3-(2-pyrimidinyl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 4-(3-pyrimidin-2-ylphenyl)-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 4-[3-(2-pyrimidyl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C20H13F3N4O MolecularWeight: 382.33863

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=C(C=C(C=C2)C(F)(F)F)NC1=O)C3=CC=CC(=C3)C4=NC=CC=N4

Isomeric SMILES

C1C(=NC2=C(C=C(C=C2)C(F)(F)F)NC1=O)C3=CC=CC(=C3)C4=NC=CC=N4

InChI

InChI=1S/C20H13F3N4O/c21-20(22,23)14-5-6-15-17(10-14)27-18(28)11-16(26-15)12-3-1-4-13(9-12)19-24-7-2-8-25-19/h1-10H,11H2,(H,27,28)