N-tert-butyl-3-nitro-4-(pyridin-3-ylmethylamino)benzenesulfonamide

Systemtic Name: N-tert-butyl-3-nitro-4-(pyridin-3-ylmethylamino)benzenesulfonamide Openeye Name: N-tert-butyl-3-nitro-4-(3-pyridylmethylamino)benzenesulfonamide CAS Name: N-tert-butyl-3-nitro-4-(3-pyridinylmethylamino)benzenesulfonamide IUPAC Name: N-tert-butyl-3-nitro-4-(pyridin-3-ylmethylamino)benzenesulfonamide Traditional Name: N-tert-butyl-3-nitro-4-(3-pyridylmethylamino)benzenesulfonamide Formula: C16H20N4O4S MolecularWeight: 364.4194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NCC2=CN=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NCC2=CN=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O4S/c1-16(2,3)19-25(23,24)13-6-7-14(15(9-13)20(21)22)18-11-12-5-4-8-17-10-12/h4-10,18-19H,11H2,1-3H3