2-[2-[7-chloranyl-6-(2-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[7-chloranyl-6-(2-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[7-chloro-6-(2-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[7-chloro-6-(2-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[7-chloro-6-(2-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[7-chloro-6-(2-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(=CC=C3)Cl)C(=N1)C4=CC=CC=C4Cl)CCN5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

C1C2=NN=C(N2C3=C(C(=CC=C3)Cl)C(=N1)C4=CC=CC=C4Cl)CCN5C(=O)C6=CC=CC=C6C5=O

InChI

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