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

Systemtic Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(4-methylphenyl)sulfonyl-propanamide Openeye Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(p-tolylsulfonyl)propanamide CAS Name: N-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-(4-methylphenyl)sulfonylpropanamide IUPAC Name: N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-(4-methylphenyl)sulfonylpropanamide Traditional Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-tosyl-propionamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C21H23N3O3S/c1-15-9-11-19(12-10-15)28(26,27)14-13-20(25)22-21-16(2)23-24(17(21)3)18-7-5-4-6-8-18/h4-12H,13-14H2,1-3H3,(H,22,25)