4-[[6-(2-tert-butylhydrazinyl)-5-nitro-pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[[6-(2-tert-butylhydrazinyl)-5-nitro-pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[[6-(2-tert-butylhydrazino)-5-nitro-pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[[6-(tert-butylhydrazo)-5-nitro-4-pyrimidinyl]amino]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[[6-(2-tert-butylhydrazinyl)-5-nitropyrimidin-4-yl]amino]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[[6-(N'-tert-butylhydrazino)-5-nitro-pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide Formula: C18H27N7O4S MolecularWeight: 437.51648

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)NNC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)NNC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H27N7O4S/c1-6-24(7-2)30(28,29)14-10-8-13(9-11-14)21-16-15(25(26)27)17(20-12-19-16)22-23-18(3,4)5/h8-12,23H,6-7H2,1-5H3,(H2,19,20,21,22)