N-methylsulfonyl-2-[2-(phenylsulfonyl)ethylsulfanyl]-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide

Systemtic Name: N-methylsulfonyl-2-[2-(phenylsulfonyl)ethylsulfanyl]-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide Openeye Name: 2-[2-(benzenesulfonyl)ethylsulfanyl]-N-methylsulfonyl-N-(1,3,5-trimethylpyrazol-4-yl)acetamide CAS Name: 2-[2-(benzenesulfonyl)ethylthio]-N-methylsulfonyl-N-(1,3,5-trimethyl-4-pyrazolyl)acetamide IUPAC Name: 2-[2-(benzenesulfonyl)ethylsulfanyl]-N-methylsulfonyl-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Traditional Name: 2-(2-besylethylthio)-N-mesyl-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Formula: C17H23N3O5S3 MolecularWeight: 445.57662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)N(C(=O)CSCCS(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=NN1C)C)N(C(=O)CSCCS(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C17H23N3O5S3/c1-13-17(14(2)19(3)18-13)20(27(4,22)23)16(21)12-26-10-11-28(24,25)15-8-6-5-7-9-15/h5-9H,10-12H2,1-4H3