N-[2-[8-chloranyl-6-(2-fluorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethyl]-2-methanoyl-benzamide

Systemtic Name: N-[2-[8-chloranyl-6-(2-fluorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethyl]-2-methanoyl-benzamide Openeye Name: N-[2-[8-chloro-6-(2-fluorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethyl]-2-formyl-benzamide CAS Name: N-[2-[8-chloro-6-(2-fluorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethyl]-2-formylbenzamide IUPAC Name: N-[2-[8-chloro-6-(2-fluorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethyl]-2-formylbenzamide Traditional Name: N-[2-[8-chloro-6-(2-fluorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethyl]-2-formyl-benzamide Formula: C26H19ClFN5O2 MolecularWeight: 487.912763

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=NN=C(N2C3=C(C=C(C=C3)Cl)C(=N1)C4=CC=CC=C4F)CCNC(=O)C5=CC=CC=C5C=O

Isomeric SMILES

C1C2=NN=C(N2C3=C(C=C(C=C3)Cl)C(=N1)C4=CC=CC=C4F)CCNC(=O)C5=CC=CC=C5C=O

InChI

InChI=1S/C26H19ClFN5O2/c27-17-9-10-22-20(13-17)25(19-7-3-4-8-21(19)28)30-14-24-32-31-23(33(22)24)11-12-29-26(35)18-6-2-1-5-16(18)15-34/h1-10,13,15H,11-12,14H2,(H,29,35)