2-[2-[8-chloranyl-6-(3-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[8-chloranyl-6-(3-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[8-chloro-6-(3-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[8-chloro-6-(3-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[8-chloro-6-(3-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[8-chloro-6-(3-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethyl]isoindoline-1,3-quinone Formula: C26H17Cl2N5O2 MolecularWeight: 502.35148

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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=C4)Cl)CCN5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

C1C2=NN=C(N2C3=C(C=C(C=C3)Cl)C(=N1)C4=CC(=CC=C4)Cl)CCN5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C26H17Cl2N5O2/c27-16-5-3-4-15(12-16)24-20-13-17(28)8-9-21(20)33-22(30-31-23(33)14-29-24)10-11-32-25(34)18-6-1-2-7-19(18)26(32)35/h1-9,12-13H,10-11,14H2