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

Systemtic Name: N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]-2,3-dimethyl-5-nitro-benzenesulfonamide Openeye Name: N-[3,5-dimethyl-1-(p-tolyl)pyrazol-4-yl]-2,3-dimethyl-5-nitro-benzenesulfonamide CAS Name: N-[3,5-dimethyl-1-(4-methylphenyl)-4-pyrazolyl]-2,3-dimethyl-5-nitrobenzenesulfonamide IUPAC Name: N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]-2,3-dimethyl-5-nitrobenzenesulfonamide Traditional Name: N-[3,5-dimethyl-1-(p-tolyl)pyrazol-4-yl]-2,3-dimethyl-5-nitro-benzenesulfonamide Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)NS(=O)(=O)C3=C(C(=CC(=C3)[N+](=O)[O-])C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)NS(=O)(=O)C3=C(C(=CC(=C3)[N+](=O)[O-])C)C)C

InChI

InChI=1S/C20H22N4O4S/c1-12-6-8-17(9-7-12)23-16(5)20(15(4)21-23)22-29(27,28)19-11-18(24(25)26)10-13(2)14(19)3/h6-11,22H,1-5H3