N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-methyl-pyrazol-3-yl]-2-(4-cyano-2-methoxy-phenoxy)ethanamide

Systemtic Name: N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-methyl-pyrazol-3-yl]-2-(4-cyano-2-methoxy-phenoxy)ethanamide Openeye Name: 2-(4-cyano-2-methoxy-phenoxy)-N-[2-(1,1-dioxothiolan-3-yl)-5-methyl-pyrazol-3-yl]acetamide CAS Name: 2-(4-cyano-2-methoxyphenoxy)-N-[2-(1,1-dioxo-3-thiolanyl)-5-methyl-3-pyrazolyl]acetamide IUPAC Name: 2-(4-cyano-2-methoxyphenoxy)-N-[2-(1,1-dioxothiolan-3-yl)-5-methylpyrazol-3-yl]acetamide Traditional Name: 2-(4-cyano-2-methoxy-phenoxy)-N-[2-(1,1-diketothiolan-3-yl)-5-methyl-pyrazol-3-yl]acetamide Formula: C18H20N4O5S MolecularWeight: 404.4402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)COC2=C(C=C(C=C2)C#N)OC)C3CCS(=O)(=O)C3

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)COC2=C(C=C(C=C2)C#N)OC)C3CCS(=O)(=O)C3

InChI

InChI=1S/C18H20N4O5S/c1-12-7-17(22(21-12)14-5-6-28(24,25)11-14)20-18(23)10-27-15-4-3-13(9-19)8-16(15)26-2/h3-4,7-8,14H,5-6,10-11H2,1-2H3,(H,20,23)