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

Systemtic Name: N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-tert-butyl-pyrazol-3-yl]-2-(4-phenylphenyl)ethanamide Openeye Name: N-[5-tert-butyl-2-(1,1-dioxothiolan-3-yl)pyrazol-3-yl]-2-(4-phenylphenyl)acetamide CAS Name: N-[5-tert-butyl-2-(1,1-dioxo-3-thiolanyl)-3-pyrazolyl]-2-(4-phenylphenyl)acetamide IUPAC Name: N-[5-tert-butyl-2-(1,1-dioxothiolan-3-yl)pyrazol-3-yl]-2-(4-phenylphenyl)acetamide Traditional Name: N-[5-tert-butyl-2-(1,1-diketothiolan-3-yl)pyrazol-3-yl]-2-(4-phenylphenyl)acetamide Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CC2=CC=C(C=C2)C3=CC=CC=C3)C4CCS(=O)(=O)C4

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CC2=CC=C(C=C2)C3=CC=CC=C3)C4CCS(=O)(=O)C4

InChI

InChI=1S/C25H29N3O3S/c1-25(2,3)22-16-23(28(27-22)21-13-14-32(30,31)17-21)26-24(29)15-18-9-11-20(12-10-18)19-7-5-4-6-8-19/h4-12,16,21H,13-15,17H2,1-3H3,(H,26,29)