N-[5-methyl-2-(2-methylphenyl)-4-phenyl-pyrazol-3-yl]-2-[(4-nitrophenyl)sulfonyl-propyl-amino]ethanamide

Systemtic Name: N-[5-methyl-2-(2-methylphenyl)-4-phenyl-pyrazol-3-yl]-2-[(4-nitrophenyl)sulfonyl-propyl-amino]ethanamide Openeye Name: N-[5-methyl-2-(o-tolyl)-4-phenyl-pyrazol-3-yl]-2-[(4-nitrophenyl)sulfonyl-propyl-amino]acetamide CAS Name: N-[5-methyl-2-(2-methylphenyl)-4-phenyl-3-pyrazolyl]-2-[(4-nitrophenyl)sulfonyl-propylamino]acetamide IUPAC Name: N-[5-methyl-2-(2-methylphenyl)-4-phenylpyrazol-3-yl]-2-[(4-nitrophenyl)sulfonyl-propylamino]acetamide Traditional Name: N-[5-methyl-2-(o-tolyl)-4-phenyl-pyrazol-3-yl]-2-[nosyl(propyl)amino]acetamide Formula: C28H29N5O5S MolecularWeight: 547.62536

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=C(C(=NN1C2=CC=CC=C2C)C)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCN(CC(=O)NC1=C(C(=NN1C2=CC=CC=C2C)C)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C28H29N5O5S/c1-4-18-31(39(37,38)24-16-14-23(15-17-24)33(35)36)19-26(34)29-28-27(22-11-6-5-7-12-22)21(3)30-32(28)25-13-9-8-10-20(25)2/h5-17H,4,18-19H2,1-3H3,(H,29,34)