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

Systemtic Name: N-[2-[(2-methylphenyl)methyl]-5-methylsulfanyl-4-(phenylsulfonyl)pyrazol-3-yl]-N-propanoyl-propanamide Openeye Name: N-[4-(benzenesulfonyl)-5-methylsulfanyl-2-(o-tolylmethyl)pyrazol-3-yl]-N-propanoyl-propanamide CAS Name: N-[4-(benzenesulfonyl)-2-[(2-methylphenyl)methyl]-5-(methylthio)-3-pyrazolyl]-N-(1-oxopropyl)propanamide IUPAC Name: N-[4-(benzenesulfonyl)-2-[(2-methylphenyl)methyl]-5-methylsulfanylpyrazol-3-yl]-N-propanoylpropanamide Traditional Name: N-[4-besyl-2-(2-methylbenzyl)-5-(methylthio)pyrazol-3-yl]-N-propionyl-propionamide Formula: C24H27N3O4S2 MolecularWeight: 485.61888

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=C(C(=NN1CC2=CC=CC=C2C)SC)S(=O)(=O)C3=CC=CC=C3)C(=O)CC

Isomeric SMILES

CCC(=O)N(C1=C(C(=NN1CC2=CC=CC=C2C)SC)S(=O)(=O)C3=CC=CC=C3)C(=O)CC

InChI

InChI=1S/C24H27N3O4S2/c1-5-20(28)27(21(29)6-2)24-22(33(30,31)19-14-8-7-9-15-19)23(32-4)25-26(24)16-18-13-11-10-12-17(18)3/h7-15H,5-6,16H2,1-4H3