4-[[(1-methylpyrazol-4-yl)carbonylamino]methyl]benzenesulfonyl chloride

Systemtic Name: 4-[[(1-methylpyrazol-4-yl)carbonylamino]methyl]benzenesulfonyl chloride Openeye Name: 4-[[(1-methylpyrazole-4-carbonyl)amino]methyl]benzenesulfonyl chloride CAS Name: 4-[[[(1-methyl-4-pyrazolyl)-oxomethyl]amino]methyl]benzenesulfonyl chloride IUPAC Name: 4-[[(1-methylpyrazole-4-carbonyl)amino]methyl]benzenesulfonyl chloride Traditional Name: 4-[[(1-methylpyrazole-4-carbonyl)amino]methyl]benzenesulfonyl chloride Formula: C12H12ClN3O3S MolecularWeight: 313.75998

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)Cl

Isomeric SMILES

CN1C=C(C=N1)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)Cl

InChI

InChI=1S/C12H12ClN3O3S/c1-16-8-10(7-15-16)12(17)14-6-9-2-4-11(5-3-9)20(13,18)19/h2-5,7-8H,6H2,1H3,(H,14,17)