N,1-dimethyl-3,5-dinitro-6-[4-(phenylsulfonyl)piperazin-1-yl]-4H-pyridin-2-amine

Systemtic Name: N,1-dimethyl-3,5-dinitro-6-[4-(phenylsulfonyl)piperazin-1-yl]-4H-pyridin-2-amine Openeye Name: 6-[4-(benzenesulfonyl)piperazin-1-yl]-N,1-dimethyl-3,5-dinitro-4H-pyridin-2-amine CAS Name: 6-[4-(benzenesulfonyl)-1-piperazinyl]-N,1-dimethyl-3,5-dinitro-4H-pyridin-2-amine IUPAC Name: 6-[4-(benzenesulfonyl)piperazin-1-yl]-N,1-dimethyl-3,5-dinitro-4H-pyridin-2-amine Traditional Name: [6-(4-besylpiperazino)-1-methyl-3,5-dinitro-4H-pyridin-2-yl]-methyl-amine Formula: C17H22N6O6S MolecularWeight: 438.45818

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(CC(=C(N1C)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CNC1=C(CC(=C(N1C)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H22N6O6S/c1-18-16-14(22(24)25)12-15(23(26)27)17(19(16)2)20-8-10-21(11-9-20)30(28,29)13-6-4-3-5-7-13/h3-7,18H,8-12H2,1-2H3