4-[3-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyl]-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide

Systemtic Name: 4-[3-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyl]-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide Openeye Name: 4-[3-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide CAS Name: 4-[3-[2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxoethyl]-2,5-dimethyl-1-pyrrolyl]benzenesulfonamide IUPAC Name: 4-[3-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetyl]-2,5-dimethylpyrrol-1-yl]benzenesulfonamide Traditional Name: 4-[3-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide Formula: C19H21N5O5S MolecularWeight: 431.46554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)N)C)C(=O)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)N)C)C(=O)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

InChI

InChI=1S/C19H21N5O5S/c1-11-9-17(18(25)10-22-14(4)19(24(26)27)12(2)21-22)13(3)23(11)15-5-7-16(8-6-15)30(20,28)29/h5-9H,10H2,1-4H3,(H2,20,28,29)