N-[[6-(3,5-dimethylpyrazol-1-yl)pyridin-3-yl]methyl]-3-(4-methylphenyl)sulfonyl-propanamide

Systemtic Name: N-[[6-(3,5-dimethylpyrazol-1-yl)pyridin-3-yl]methyl]-3-(4-methylphenyl)sulfonyl-propanamide Openeye Name: N-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridyl]methyl]-3-(p-tolylsulfonyl)propanamide CAS Name: N-[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridinyl]methyl]-3-(4-methylphenyl)sulfonylpropanamide IUPAC Name: N-[[6-(3,5-dimethylpyrazol-1-yl)pyridin-3-yl]methyl]-3-(4-methylphenyl)sulfonylpropanamide Traditional Name: N-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridyl]methyl]-3-tosyl-propionamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NCC2=CN=C(C=C2)N3C(=CC(=N3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NCC2=CN=C(C=C2)N3C(=CC(=N3)C)C

InChI

InChI=1S/C21H24N4O3S/c1-15-4-7-19(8-5-15)29(27,28)11-10-21(26)23-14-18-6-9-20(22-13-18)25-17(3)12-16(2)24-25/h4-9,12-13H,10-11,14H2,1-3H3,(H,23,26)