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

Systemtic Name: N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-tert-butyl-pyrazol-3-yl]-3-chloranyl-4,5-dimethoxy-benzamide Openeye Name: N-[5-tert-butyl-2-(1,1-dioxothiolan-3-yl)pyrazol-3-yl]-3-chloro-4,5-dimethoxy-benzamide CAS Name: N-[5-tert-butyl-2-(1,1-dioxo-3-thiolanyl)-3-pyrazolyl]-3-chloro-4,5-dimethoxybenzamide IUPAC Name: N-[5-tert-butyl-2-(1,1-dioxothiolan-3-yl)pyrazol-3-yl]-3-chloro-4,5-dimethoxybenzamide Traditional Name: N-[5-tert-butyl-2-(1,1-diketothiolan-3-yl)pyrazol-3-yl]-3-chloro-4,5-dimethoxy-benzamide Formula: C20H26ClN3O5S MolecularWeight: 455.95554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=CC(=C(C(=C2)Cl)OC)OC)C3CCS(=O)(=O)C3

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=CC(=C(C(=C2)Cl)OC)OC)C3CCS(=O)(=O)C3

InChI

InChI=1S/C20H26ClN3O5S/c1-20(2,3)16-10-17(24(23-16)13-6-7-30(26,27)11-13)22-19(25)12-8-14(21)18(29-5)15(9-12)28-4/h8-10,13H,6-7,11H2,1-5H3,(H,22,25)