3-nitro-N-propan-2-yl-4-[[(1R)-1-pyridin-2-ylethyl]amino]benzenesulfonamide

Systemtic Name: 3-nitro-N-propan-2-yl-4-[[(1R)-1-pyridin-2-ylethyl]amino]benzenesulfonamide Openeye Name: N-isopropyl-3-nitro-4-[[(1R)-1-(2-pyridyl)ethyl]amino]benzenesulfonamide CAS Name: 3-nitro-N-propan-2-yl-4-[[(1R)-1-(2-pyridinyl)ethyl]amino]benzenesulfonamide IUPAC Name: 3-nitro-N-propan-2-yl-4-[[(1R)-1-pyridin-2-ylethyl]amino]benzenesulfonamide Traditional Name: N-isopropyl-3-nitro-4-[[(1R)-1-(2-pyridyl)ethyl]amino]benzenesulfonamide Formula: C16H20N4O4S MolecularWeight: 364.4194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NC(C)C2=CC=CC=N2)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=CC=CC=N1)NC2=C(C=C(C=C2)S(=O)(=O)NC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O4S/c1-11(2)19-25(23,24)13-7-8-15(16(10-13)20(21)22)18-12(3)14-6-4-5-9-17-14/h4-12,18-19H,1-3H3/t12-/m1/s1