N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-tert-butyl-pyrazol-3-yl]-5-oxidanylidene-5-thiophen-2-yl-pentanamide

Systemtic Name: N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-tert-butyl-pyrazol-3-yl]-5-oxidanylidene-5-thiophen-2-yl-pentanamide Openeye Name: N-[5-tert-butyl-2-(1,1-dioxothiolan-3-yl)pyrazol-3-yl]-5-oxo-5-(2-thienyl)pentanamide CAS Name: N-[5-tert-butyl-2-(1,1-dioxo-3-thiolanyl)-3-pyrazolyl]-5-oxo-5-thiophen-2-ylpentanamide IUPAC Name: N-[5-tert-butyl-2-(1,1-dioxothiolan-3-yl)pyrazol-3-yl]-5-oxo-5-thiophen-2-ylpentanamide Traditional Name: N-[5-tert-butyl-2-(1,1-diketothiolan-3-yl)pyrazol-3-yl]-5-keto-5-(2-thienyl)valeramide Formula: C20H27N3O4S2 MolecularWeight: 437.57608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CCCC(=O)C2=CC=CS2)C3CCS(=O)(=O)C3

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CCCC(=O)C2=CC=CS2)C3CCS(=O)(=O)C3

InChI

InChI=1S/C20H27N3O4S2/c1-20(2,3)17-12-18(23(22-17)14-9-11-29(26,27)13-14)21-19(25)8-4-6-15(24)16-7-5-10-28-16/h5,7,10,12,14H,4,6,8-9,11,13H2,1-3H3,(H,21,25)