N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]-2-(4-nitropyrazol-1-yl)butanamide

Systemtic Name: N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]-2-(4-nitropyrazol-1-yl)butanamide Openeye Name: N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]-2-(4-nitropyrazol-1-yl)butanamide CAS Name: N-[3-(4-chlorophenyl)sulfonyl-5-methoxyphenyl]-2-(4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[3-(4-chlorophenyl)sulfonyl-5-methoxyphenyl]-2-(4-nitropyrazol-1-yl)butanamide Traditional Name: N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]-2-(4-nitropyrazol-1-yl)butyramide Formula: C20H19ClN4O6S MolecularWeight: 478.90606

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=CC(=C1)S(=O)(=O)C2=CC=C(C=C2)Cl)OC)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NC1=CC(=CC(=C1)S(=O)(=O)C2=CC=C(C=C2)Cl)OC)N3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C20H19ClN4O6S/c1-3-19(24-12-15(11-22-24)25(27)28)20(26)23-14-8-16(31-2)10-18(9-14)32(29,30)17-6-4-13(21)5-7-17/h4-12,19H,3H2,1-2H3,(H,23,26)