4-[[6-(diethylamino)pyridin-3-yl]amino]-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[[6-(diethylamino)pyridin-3-yl]amino]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[[6-(diethylamino)-3-pyridyl]amino]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[[6-(diethylamino)-3-pyridinyl]amino]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[[6-(diethylamino)pyridin-3-yl]amino]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[[6-(diethylamino)-3-pyridyl]amino]-N-methyl-3-nitro-benzenesulfonamide Formula: C16H21N5O4S MolecularWeight: 379.43404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N5O4S/c1-4-20(5-2)16-9-6-12(11-18-16)19-14-8-7-13(26(24,25)17-3)10-15(14)21(22)23/h6-11,17,19H,4-5H2,1-3H3