3-methylsulfonyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine

Systemtic Name: 3-methylsulfonyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Openeye Name: 3-methylsulfonyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine CAS Name: 3-methylsulfonyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine IUPAC Name: 3-methylsulfonyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Traditional Name: 3-mesyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Formula: C12H11N3O2S MolecularWeight: 261.29964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NN=C2N1C=CC3=CC=CC=C3C2

Isomeric SMILES

CS(=O)(=O)C1=NN=C2N1C=CC3=CC=CC=C3C2

InChI

InChI=1S/C12H11N3O2S/c1-18(16,17)12-14-13-11-8-10-5-3-2-4-9(10)6-7-15(11)12/h2-7H,8H2,1H3