2-butyl-7-methyl-1-[4-(phenylsulfonyl)butyl]imidazo[4,5-c]pyridin-4-amine

Systemtic Name: 2-butyl-7-methyl-1-[4-(phenylsulfonyl)butyl]imidazo[4,5-c]pyridin-4-amine Openeye Name: 1-[4-(benzenesulfonyl)butyl]-2-butyl-7-methyl-imidazo[4,5-c]pyridin-4-amine CAS Name: 1-[4-(benzenesulfonyl)butyl]-2-butyl-7-methyl-4-imidazo[4,5-c]pyridinamine IUPAC Name: 1-[4-(benzenesulfonyl)butyl]-2-butyl-7-methylimidazo[4,5-c]pyridin-4-amine Traditional Name: [1-(4-besylbutyl)-2-butyl-7-methyl-imidazo[4,5-c]pyridin-4-yl]amine Formula: C21H28N4O2S MolecularWeight: 400.53762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CCCCS(=O)(=O)C3=CC=CC=C3)C(=CN=C2N)C

Isomeric SMILES

CCCCC1=NC2=C(N1CCCCS(=O)(=O)C3=CC=CC=C3)C(=CN=C2N)C

InChI

InChI=1S/C21H28N4O2S/c1-3-4-12-18-24-19-20(16(2)15-23-21(19)22)25(18)13-8-9-14-28(26,27)17-10-6-5-7-11-17/h5-7,10-11,15H,3-4,8-9,12-14H2,1-2H3,(H2,22,23)