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

Systemtic Name: N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-tert-butyl-pyrazol-3-yl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[5-tert-butyl-2-(1,1-dioxothiolan-3-yl)pyrazol-3-yl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[5-tert-butyl-2-(1,1-dioxo-3-thiolanyl)-3-pyrazolyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[5-tert-butyl-2-(1,1-dioxothiolan-3-yl)pyrazol-3-yl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[5-tert-butyl-2-(1,1-diketothiolan-3-yl)pyrazol-3-yl]-3-pyrrolidinosulfonyl-benzamide Formula: C22H30N4O5S2 MolecularWeight: 494.6274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3)C4CCS(=O)(=O)C4

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3)C4CCS(=O)(=O)C4

InChI

InChI=1S/C22H30N4O5S2/c1-22(2,3)19-14-20(26(24-19)17-9-12-32(28,29)15-17)23-21(27)16-7-6-8-18(13-16)33(30,31)25-10-4-5-11-25/h6-8,13-14,17H,4-5,9-12,15H2,1-3H3,(H,23,27)