N-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]-3-(methylsulfonylmethyl)benzamide

Systemtic Name: N-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]-3-(methylsulfonylmethyl)benzamide Openeye Name: N-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]-3-(methylsulfonylmethyl)benzamide CAS Name: N-[2-[4-(3,5-dimethyl-1-pyrazolyl)phenyl]ethyl]-3-(methylsulfonylmethyl)benzamide IUPAC Name: N-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]-3-(methylsulfonylmethyl)benzamide Traditional Name: N-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]-3-(mesylmethyl)benzamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)CCNC(=O)C3=CC(=CC=C3)CS(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)CCNC(=O)C3=CC(=CC=C3)CS(=O)(=O)C)C

InChI

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