4-(azepan-1-ylcarbonyl)-1,2,5-trimethyl-N-(4-methylpyridin-2-yl)pyrrole-3-sulfonamide

Systemtic Name: 4-(azepan-1-ylcarbonyl)-1,2,5-trimethyl-N-(4-methylpyridin-2-yl)pyrrole-3-sulfonamide Openeye Name: 4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-(4-methyl-2-pyridyl)pyrrole-3-sulfonamide CAS Name: 4-[1-azepanyl(oxo)methyl]-1,2,5-trimethyl-N-(4-methyl-2-pyridinyl)-3-pyrrolesulfonamide IUPAC Name: 4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-(4-methylpyridin-2-yl)pyrrole-3-sulfonamide Traditional Name: 4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-(4-methyl-2-pyridyl)pyrrole-3-sulfonamide Formula: C20H28N4O3S MolecularWeight: 404.52632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)NS(=O)(=O)C2=C(N(C(=C2C(=O)N3CCCCCC3)C)C)C

Isomeric SMILES

CC1=CC(=NC=C1)NS(=O)(=O)C2=C(N(C(=C2C(=O)N3CCCCCC3)C)C)C

InChI

InChI=1S/C20H28N4O3S/c1-14-9-10-21-17(13-14)22-28(26,27)19-16(3)23(4)15(2)18(19)20(25)24-11-7-5-6-8-12-24/h9-10,13H,5-8,11-12H2,1-4H3,(H,21,22)