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

Systemtic Name: N-[[1,1-bis(oxidanylidene)thiolan-3-yl]methyl]-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide Openeye Name: N-[(1,1-dioxothiolan-3-yl)methyl]-3-(p-tolyl)-1H-pyrazole-5-carboxamide CAS Name: N-[(1,1-dioxo-3-thiolanyl)methyl]-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide IUPAC Name: N-[(1,1-dioxothiolan-3-yl)methyl]-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide Traditional Name: N-[(1,1-diketothiolan-3-yl)methyl]-3-(p-tolyl)-1H-pyrazole-5-carboxamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NCC3CCS(=O)(=O)C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NCC3CCS(=O)(=O)C3

InChI

InChI=1S/C16H19N3O3S/c1-11-2-4-13(5-3-11)14-8-15(19-18-14)16(20)17-9-12-6-7-23(21,22)10-12/h2-5,8,12H,6-7,9-10H2,1H3,(H,17,20)(H,18,19)