N-[[1,1-bis(oxidanylidene)thiolan-3-yl]methyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide

Systemtic Name: N-[[1,1-bis(oxidanylidene)thiolan-3-yl]methyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide Openeye Name: N-[(1,1-dioxothiolan-3-yl)methyl]-5-ethyl-1-(p-tolyl)pyrazole-4-carboxamide CAS Name: N-[(1,1-dioxo-3-thiolanyl)methyl]-5-ethyl-1-(4-methylphenyl)-4-pyrazolecarboxamide IUPAC Name: N-[(1,1-dioxothiolan-3-yl)methyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide Traditional Name: N-[(1,1-diketothiolan-3-yl)methyl]-5-ethyl-1-(p-tolyl)pyrazole-4-carboxamide Formula: C18H23N3O3S MolecularWeight: 361.45852

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC=C(C=C2)C)C(=O)NCC3CCS(=O)(=O)C3

Isomeric SMILES

CCC1=C(C=NN1C2=CC=C(C=C2)C)C(=O)NCC3CCS(=O)(=O)C3

InChI

InChI=1S/C18H23N3O3S/c1-3-17-16(11-20-21(17)15-6-4-13(2)5-7-15)18(22)19-10-14-8-9-25(23,24)12-14/h4-7,11,14H,3,8-10,12H2,1-2H3,(H,19,22)