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

Systemtic Name: 3-ethylsulfonyl-11-methyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Openeye Name: 3-ethylsulfonyl-11-methyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine CAS Name: 3-ethylsulfonyl-11-methyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine IUPAC Name: 3-ethylsulfonyl-11-methyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Traditional Name: 3-esyl-11-methyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Formula: C14H15N3O2S MolecularWeight: 289.3528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NN=C2N1C=CC3=CC=CC=C3C2C

Isomeric SMILES

CCS(=O)(=O)C1=NN=C2N1C=CC3=CC=CC=C3C2C

InChI

InChI=1S/C14H15N3O2S/c1-3-20(18,19)14-16-15-13-10(2)12-7-5-4-6-11(12)8-9-17(13)14/h4-10H,3H2,1-2H3