N-ethanoyl-N-[2-[(3-methylphenyl)methyl]-5-methylsulfanyl-4-(phenylsulfonyl)pyrazol-3-yl]ethanamide

Systemtic Name: N-ethanoyl-N-[2-[(3-methylphenyl)methyl]-5-methylsulfanyl-4-(phenylsulfonyl)pyrazol-3-yl]ethanamide Openeye Name: N-acetyl-N-[4-(benzenesulfonyl)-5-methylsulfanyl-2-(m-tolylmethyl)pyrazol-3-yl]acetamide CAS Name: N-acetyl-N-[4-(benzenesulfonyl)-2-[(3-methylphenyl)methyl]-5-(methylthio)-3-pyrazolyl]acetamide IUPAC Name: N-acetyl-N-[4-(benzenesulfonyl)-2-[(3-methylphenyl)methyl]-5-methylsulfanylpyrazol-3-yl]acetamide Traditional Name: N-acetyl-N-[4-besyl-2-(3-methylbenzyl)-5-(methylthio)pyrazol-3-yl]acetamide Formula: C22H23N3O4S2 MolecularWeight: 457.56572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C(=C(C(=N2)SC)S(=O)(=O)C3=CC=CC=C3)N(C(=O)C)C(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C(=C(C(=N2)SC)S(=O)(=O)C3=CC=CC=C3)N(C(=O)C)C(=O)C

InChI

InChI=1S/C22H23N3O4S2/c1-15-9-8-10-18(13-15)14-24-22(25(16(2)26)17(3)27)20(21(23-24)30-4)31(28,29)19-11-6-5-7-12-19/h5-13H,14H2,1-4H3