4-methyl-3-nitro-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzenesulfonamide

Systemtic Name: 4-methyl-3-nitro-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzenesulfonamide Openeye Name: 4-methyl-3-nitro-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzenesulfonamide CAS Name: 4-methyl-3-nitro-N-[2-(1-phenyl-4-pyrazolyl)ethyl]benzenesulfonamide IUPAC Name: 4-methyl-3-nitro-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzenesulfonamide Traditional Name: 4-methyl-3-nitro-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzenesulfonamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCC2=CN(N=C2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCC2=CN(N=C2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O4S/c1-14-7-8-17(11-18(14)22(23)24)27(25,26)20-10-9-15-12-19-21(13-15)16-5-3-2-4-6-16/h2-8,11-13,20H,9-10H2,1H3