N-(4-methylcyclohexyl)-3-nitro-4-(2-pyridin-2-ylethylamino)benzenesulfonamide

Systemtic Name: N-(4-methylcyclohexyl)-3-nitro-4-(2-pyridin-2-ylethylamino)benzenesulfonamide Openeye Name: N-(4-methylcyclohexyl)-3-nitro-4-[2-(2-pyridyl)ethylamino]benzenesulfonamide CAS Name: N-(4-methylcyclohexyl)-3-nitro-4-[2-(2-pyridinyl)ethylamino]benzenesulfonamide IUPAC Name: N-(4-methylcyclohexyl)-3-nitro-4-(2-pyridin-2-ylethylamino)benzenesulfonamide Traditional Name: N-(4-methylcyclohexyl)-3-nitro-4-[2-(2-pyridyl)ethylamino]benzenesulfonamide Formula: C20H26N4O4S MolecularWeight: 418.50984

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NS(=O)(=O)C2=CC(=C(C=C2)NCCC3=CC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1CCC(CC1)NS(=O)(=O)C2=CC(=C(C=C2)NCCC3=CC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C20H26N4O4S/c1-15-5-7-17(8-6-15)23-29(27,28)18-9-10-19(20(14-18)24(25)26)22-13-11-16-4-2-3-12-21-16/h2-4,9-10,12,14-15,17,22-23H,5-8,11,13H2,1H3