N,N-diethyl-3-[[(5-nitrothiophen-3-yl)carbonylamino]carbamoyl]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-[[(5-nitrothiophen-3-yl)carbonylamino]carbamoyl]benzenesulfonamide Openeye Name: N,N-diethyl-3-[[(5-nitrothiophene-3-carbonyl)amino]carbamoyl]benzenesulfonamide CAS Name: N,N-diethyl-3-[[[(5-nitro-3-thiophenyl)-oxomethyl]hydrazo]-oxomethyl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-[[(5-nitrothiophene-3-carbonyl)amino]carbamoyl]benzenesulfonamide Traditional Name: N,N-diethyl-3-[[(5-nitrothiophene-3-carbonyl)amino]carbamoyl]benzenesulfonamide Formula: C16H18N4O6S2 MolecularWeight: 426.46732

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)C2=CSC(=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)C2=CSC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O6S2/c1-3-19(4-2)28(25,26)13-7-5-6-11(8-13)15(21)17-18-16(22)12-9-14(20(23)24)27-10-12/h5-10H,3-4H2,1-2H3,(H,17,21)(H,18,22)