N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(4-methylphenyl)sulfonyl-propanamide

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(4-methylphenyl)sulfonyl-propanamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(p-tolylsulfonyl)propanamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-3-(4-methylphenyl)sulfonylpropanamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-3-(4-methylphenyl)sulfonylpropanamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-tosyl-propionamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NCC2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NCC2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C22H25N3O3S/c1-16-9-11-20(12-10-16)29(27,28)14-13-22(26)23-15-21-17(2)24-25(18(21)3)19-7-5-4-6-8-19/h4-12H,13-15H2,1-3H3,(H,23,26)