(6-methoxypyrimidin-4-yl)-[4-[(5-nitro-1-benzothiophen-2-yl)carbonylamino]phenyl]sulfonyl-azanide

Systemtic Name: (6-methoxypyrimidin-4-yl)-[4-[(5-nitro-1-benzothiophen-2-yl)carbonylamino]phenyl]sulfonyl-azanide Openeye Name: (6-methoxypyrimidin-4-yl)-[4-[(5-nitrobenzothiophene-2-carbonyl)amino]phenyl]sulfonyl-azanide CAS Name: (6-methoxy-4-pyrimidinyl)-[4-[[(5-nitro-1-benzothiophen-2-yl)-oxomethyl]amino]phenyl]sulfonylazanide IUPAC Name: (6-methoxypyrimidin-4-yl)-[4-[(5-nitro-1-benzothiophene-2-carbonyl)amino]phenyl]sulfonylazanide Traditional Name: (6-methoxypyrimidin-4-yl)-[4-[(5-nitrobenzothiophene-2-carbonyl)amino]phenyl]sulfonyl-azanide Formula: C20H14N5O6S2- MolecularWeight: 484.48506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=NC(=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=NC=NC(=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H15N5O6S2/c1-31-19-10-18(21-11-22-19)24-33(29,30)15-5-2-13(3-6-15)23-20(26)17-9-12-8-14(25(27)28)4-7-16(12)32-17/h2-11H,1H3,(H2,21,22,23,24,26)/p-1