N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-methyl-pyrazol-3-yl]-2-methyl-6-phenyl-pyridine-3-carboxamide

Systemtic Name: N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-methyl-pyrazol-3-yl]-2-methyl-6-phenyl-pyridine-3-carboxamide Openeye Name: N-[2-(1,1-dioxothiolan-3-yl)-5-methyl-pyrazol-3-yl]-2-methyl-6-phenyl-pyridine-3-carboxamide CAS Name: N-[2-(1,1-dioxo-3-thiolanyl)-5-methyl-3-pyrazolyl]-2-methyl-6-phenyl-3-pyridinecarboxamide IUPAC Name: N-[2-(1,1-dioxothiolan-3-yl)-5-methylpyrazol-3-yl]-2-methyl-6-phenylpyridine-3-carboxamide Traditional Name: N-[2-(1,1-diketothiolan-3-yl)-5-methyl-pyrazol-3-yl]-2-methyl-6-phenyl-nicotinamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=C(N=C(C=C2)C3=CC=CC=C3)C)C4CCS(=O)(=O)C4

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=C(N=C(C=C2)C3=CC=CC=C3)C)C4CCS(=O)(=O)C4

InChI

InChI=1S/C21H22N4O3S/c1-14-12-20(25(24-14)17-10-11-29(27,28)13-17)23-21(26)18-8-9-19(22-15(18)2)16-6-4-3-5-7-16/h3-9,12,17H,10-11,13H2,1-2H3,(H,23,26)