N-(4-methylcyclohexyl)-3-nitro-4-(pyridin-3-ylmethylamino)benzenesulfonamide

Systemtic Name: N-(4-methylcyclohexyl)-3-nitro-4-(pyridin-3-ylmethylamino)benzenesulfonamide Openeye Name: N-(4-methylcyclohexyl)-3-nitro-4-(3-pyridylmethylamino)benzenesulfonamide CAS Name: N-(4-methylcyclohexyl)-3-nitro-4-(3-pyridinylmethylamino)benzenesulfonamide IUPAC Name: N-(4-methylcyclohexyl)-3-nitro-4-(pyridin-3-ylmethylamino)benzenesulfonamide Traditional Name: N-(4-methylcyclohexyl)-3-nitro-4-(3-pyridylmethylamino)benzenesulfonamide Formula: C19H24N4O4S MolecularWeight: 404.48326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NS(=O)(=O)C2=CC(=C(C=C2)NCC3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CCC(CC1)NS(=O)(=O)C2=CC(=C(C=C2)NCC3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H24N4O4S/c1-14-4-6-16(7-5-14)22-28(26,27)17-8-9-18(19(11-17)23(24)25)21-13-15-3-2-10-20-12-15/h2-3,8-12,14,16,21-22H,4-7,13H2,1H3