8-(4-fluorophenyl)-4-[3-(1,2,4-triazol-1-yl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: 8-(4-fluorophenyl)-4-[3-(1,2,4-triazol-1-yl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 8-(4-fluorophenyl)-4-[3-(1,2,4-triazol-1-yl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 8-(4-fluorophenyl)-4-[3-(1,2,4-triazol-1-yl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 8-(4-fluorophenyl)-4-[3-(1,2,4-triazol-1-yl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 8-(4-fluorophenyl)-4-[3-(1,2,4-triazol-1-yl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C23H16FN5O MolecularWeight: 397.404443

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=C(C=C(C=C2)C3=CC=C(C=C3)F)NC1=O)C4=CC(=CC=C4)N5C=NC=N5

Isomeric SMILES

C1C(=NC2=C(C=C(C=C2)C3=CC=C(C=C3)F)NC1=O)C4=CC(=CC=C4)N5C=NC=N5

InChI

InChI=1S/C23H16FN5O/c24-18-7-4-15(5-8-18)16-6-9-20-22(11-16)28-23(30)12-21(27-20)17-2-1-3-19(10-17)29-14-25-13-26-29/h1-11,13-14H,12H2,(H,28,30)