N-(4-azanyl-2-cyano-phenyl)azepane-1-sulfonamide

Systemtic Name: N-(4-azanyl-2-cyano-phenyl)azepane-1-sulfonamide Openeye Name: N-(4-amino-2-cyano-phenyl)azepane-1-sulfonamide CAS Name: N-(4-amino-2-cyanophenyl)-1-azepanesulfonamide IUPAC Name: N-(4-amino-2-cyanophenyl)azepane-1-sulfonamide Traditional Name: N-(4-amino-2-cyano-phenyl)azepane-1-sulfonamide Formula: C13H18N4O2S MolecularWeight: 294.37262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)NC2=C(C=C(C=C2)N)C#N

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)NC2=C(C=C(C=C2)N)C#N

InChI

InChI=1S/C13H18N4O2S/c14-10-11-9-12(15)5-6-13(11)16-20(18,19)17-7-3-1-2-4-8-17/h5-6,9,16H,1-4,7-8,15H2