N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-1,1-bis(oxidanylidene)thiolane-3-carboxamide

Systemtic Name: N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-1,1-bis(oxidanylidene)thiolane-3-carboxamide Openeye Name: N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-1,1-dioxo-thiolane-3-carboxamide CAS Name: N-[[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]methyl]-N-methyl-1,1-dioxo-3-thiolanecarboxamide IUPAC Name: N-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methyl]-N-methyl-1,1-dioxothiolane-3-carboxamide Traditional Name: N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-1,1-diketo-N-methyl-thiolane-3-carboxamide Formula: C22H22ClN3O3S MolecularWeight: 443.94638

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1C2=CC=C(C=C2)Cl)C3=CC=CC=C3)C(=O)C4CCS(=O)(=O)C4

Isomeric SMILES

CN(CC1=CN(N=C1C2=CC=C(C=C2)Cl)C3=CC=CC=C3)C(=O)C4CCS(=O)(=O)C4

InChI

InChI=1S/C22H22ClN3O3S/c1-25(22(27)17-11-12-30(28,29)15-17)13-18-14-26(20-5-3-2-4-6-20)24-21(18)16-7-9-19(23)10-8-16/h2-10,14,17H,11-13,15H2,1H3