8-bromanyl-2-ethyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-one

Systemtic Name: 8-bromanyl-2-ethyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-one Openeye Name: 8-bromo-2-ethyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-one CAS Name: 8-bromo-2-ethyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-one IUPAC Name: 8-bromo-2-ethyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-one Traditional Name: 8-bromo-2-ethyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-one Formula: C18H15BrN4O MolecularWeight: 383.2419

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)N2C(=N1)CN=C(C3=C2C=CC(=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=O)N2C(=N1)CN=C(C3=C2C=CC(=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C18H15BrN4O/c1-2-22-18(24)23-15-9-8-13(19)10-14(15)17(20-11-16(23)21-22)12-6-4-3-5-7-12/h3-10H,2,11H2,1H3