8-chloranyl-4-(3-pyridin-3-ylphenyl)-7-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: 8-chloranyl-4-(3-pyridin-3-ylphenyl)-7-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 8-chloro-4-[3-(3-pyridyl)phenyl]-7-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 8-chloro-4-[3-(3-pyridinyl)phenyl]-7-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 8-chloro-4-(3-pyridin-3-ylphenyl)-7-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 8-chloro-4-[3-(3-pyridyl)phenyl]-7-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C21H13ClF3N3O MolecularWeight: 415.79563

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=C(C=C(C(=C2)C(F)(F)F)Cl)NC1=O)C3=CC=CC(=C3)C4=CN=CC=C4

Isomeric SMILES

C1C(=NC2=C(C=C(C(=C2)C(F)(F)F)Cl)NC1=O)C3=CC=CC(=C3)C4=CN=CC=C4

InChI

InChI=1S/C21H13ClF3N3O/c22-16-9-19-18(8-15(16)21(23,24)25)27-17(10-20(29)28-19)13-4-1-3-12(7-13)14-5-2-6-26-11-14/h1-9,11H,10H2,(H,28,29)