7-bromanyl-1-ethyl-5-pyridin-2-yl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-bromanyl-1-ethyl-5-pyridin-2-yl-3H-1,4-benzodiazepin-2-one Openeye Name: 7-bromo-1-ethyl-5-(2-pyridyl)-3H-1,4-benzodiazepin-2-one CAS Name: 7-bromo-1-ethyl-5-(2-pyridinyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-bromo-1-ethyl-5-pyridin-2-yl-3H-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-1-ethyl-5-(2-pyridyl)-3H-1,4-benzodiazepin-2-one Formula: C16H14BrN3O MolecularWeight: 344.20586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)CN=C(C2=C1C=CC(=C2)Br)C3=CC=CC=N3

Isomeric SMILES

CCN1C(=O)CN=C(C2=C1C=CC(=C2)Br)C3=CC=CC=N3

InChI

InChI=1S/C16H14BrN3O/c1-2-20-14-7-6-11(17)9-12(14)16(19-10-15(20)21)13-5-3-4-8-18-13/h3-9H,2,10H2,1H3