N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-tert-butyl-pyrazol-3-yl]-3,4,5-triethoxy-benzamide

Systemtic Name: N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-tert-butyl-pyrazol-3-yl]-3,4,5-triethoxy-benzamide Openeye Name: N-[5-tert-butyl-2-(1,1-dioxothiolan-3-yl)pyrazol-3-yl]-3,4,5-triethoxy-benzamide CAS Name: N-[5-tert-butyl-2-(1,1-dioxo-3-thiolanyl)-3-pyrazolyl]-3,4,5-triethoxybenzamide IUPAC Name: N-[5-tert-butyl-2-(1,1-dioxothiolan-3-yl)pyrazol-3-yl]-3,4,5-triethoxybenzamide Traditional Name: N-[5-tert-butyl-2-(1,1-diketothiolan-3-yl)pyrazol-3-yl]-3,4,5-triethoxy-benzamide Formula: C24H35N3O6S MolecularWeight: 493.6162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=CC(=NN2C3CCS(=O)(=O)C3)C(C)(C)C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=CC(=NN2C3CCS(=O)(=O)C3)C(C)(C)C

InChI

InChI=1S/C24H35N3O6S/c1-7-31-18-12-16(13-19(32-8-2)22(18)33-9-3)23(28)25-21-14-20(24(4,5)6)26-27(21)17-10-11-34(29,30)15-17/h12-14,17H,7-11,15H2,1-6H3,(H,25,28)