N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]-1-methyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]-1-methyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]-1-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[3-(4-chlorophenyl)sulfonyl-5-methoxyphenyl]-1-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[3-(4-chlorophenyl)sulfonyl-5-methoxyphenyl]-1-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]-1-methyl-4-nitro-pyrazole-3-carboxamide Formula: C18H15ClN4O6S MolecularWeight: 450.8529

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NC2=CC(=CC(=C2)S(=O)(=O)C3=CC=C(C=C3)Cl)OC)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NC2=CC(=CC(=C2)S(=O)(=O)C3=CC=C(C=C3)Cl)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H15ClN4O6S/c1-22-10-16(23(25)26)17(21-22)18(24)20-12-7-13(29-2)9-15(8-12)30(27,28)14-5-3-11(19)4-6-14/h3-10H,1-2H3,(H,20,24)