8-chloranyl-1-(2-ethoxyethyl)-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine

Systemtic Name: 8-chloranyl-1-(2-ethoxyethyl)-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Openeye Name: 8-chloro-1-(2-ethoxyethyl)-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine CAS Name: 8-chloro-1-(2-ethoxyethyl)-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine IUPAC Name: 8-chloro-1-(2-ethoxyethyl)-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Traditional Name: 8-chloro-1-(2-ethoxyethyl)-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Formula: C20H19ClN4O MolecularWeight: 366.84406

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCC1=NN=C2N1C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4

Isomeric SMILES

CCOCCC1=NN=C2N1C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4

InChI

InChI=1S/C20H19ClN4O/c1-2-26-11-10-18-23-24-19-13-22-20(14-6-4-3-5-7-14)16-12-15(21)8-9-17(16)25(18)19/h3-9,12H,2,10-11,13H2,1H3