N-tert-butyl-4-[methyl(2-pyridin-2-ylethyl)amino]-3-nitro-benzenesulfonamide

Systemtic Name: N-tert-butyl-4-[methyl(2-pyridin-2-ylethyl)amino]-3-nitro-benzenesulfonamide Openeye Name: N-tert-butyl-4-[methyl-[2-(2-pyridyl)ethyl]amino]-3-nitro-benzenesulfonamide CAS Name: N-tert-butyl-4-[methyl-[2-(2-pyridinyl)ethyl]amino]-3-nitrobenzenesulfonamide IUPAC Name: N-tert-butyl-4-[methyl(2-pyridin-2-ylethyl)amino]-3-nitrobenzenesulfonamide Traditional Name: N-tert-butyl-4-[methyl-[2-(2-pyridyl)ethyl]amino]-3-nitro-benzenesulfonamide Formula: C18H24N4O4S MolecularWeight: 392.47256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)N(C)CCC2=CC=CC=N2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)N(C)CCC2=CC=CC=N2)[N+](=O)[O-]

InChI

InChI=1S/C18H24N4O4S/c1-18(2,3)20-27(25,26)15-8-9-16(17(13-15)22(23)24)21(4)12-10-14-7-5-6-11-19-14/h5-9,11,13,20H,10,12H2,1-4H3