1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-(3-ethanoylphenyl)-3,5-dimethyl-pyrazole-4-sulfonamide

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-(3-ethanoylphenyl)-3,5-dimethyl-pyrazole-4-sulfonamide Openeye Name: N-(3-acetylphenyl)-1-[(3S)-1,1-dioxothiolan-3-yl]-3,5-dimethyl-pyrazole-4-sulfonamide CAS Name: N-(3-acetylphenyl)-1-[(3S)-1,1-dioxo-3-thiolanyl]-3,5-dimethyl-4-pyrazolesulfonamide IUPAC Name: N-(3-acetylphenyl)-1-[(3S)-1,1-dioxothiolan-3-yl]-3,5-dimethylpyrazole-4-sulfonamide Traditional Name: N-(3-acetylphenyl)-1-[(3S)-1,1-diketothiolan-3-yl]-3,5-dimethyl-pyrazole-4-sulfonamide Formula: C17H21N3O5S2 MolecularWeight: 411.49574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2CCS(=O)(=O)C2)C)S(=O)(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC1=C(C(=NN1[C@H]2CCS(=O)(=O)C2)C)S(=O)(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C17H21N3O5S2/c1-11-17(12(2)20(18-11)16-7-8-26(22,23)10-16)27(24,25)19-15-6-4-5-14(9-15)13(3)21/h4-6,9,16,19H,7-8,10H2,1-3H3/t16-/m0/s1