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

Systemtic Name: N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-methyl-pyrazol-3-yl]-2-(4-phenylphenyl)ethanamide Openeye Name: N-[2-(1,1-dioxothiolan-3-yl)-5-methyl-pyrazol-3-yl]-2-(4-phenylphenyl)acetamide CAS Name: N-[2-(1,1-dioxo-3-thiolanyl)-5-methyl-3-pyrazolyl]-2-(4-phenylphenyl)acetamide IUPAC Name: N-[2-(1,1-dioxothiolan-3-yl)-5-methylpyrazol-3-yl]-2-(4-phenylphenyl)acetamide Traditional Name: N-[2-(1,1-diketothiolan-3-yl)-5-methyl-pyrazol-3-yl]-2-(4-phenylphenyl)acetamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CC2=CC=C(C=C2)C3=CC=CC=C3)C4CCS(=O)(=O)C4

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CC2=CC=C(C=C2)C3=CC=CC=C3)C4CCS(=O)(=O)C4

InChI

InChI=1S/C22H23N3O3S/c1-16-13-21(25(24-16)20-11-12-29(27,28)15-20)23-22(26)14-17-7-9-19(10-8-17)18-5-3-2-4-6-18/h2-10,13,20H,11-12,14-15H2,1H3,(H,23,26)