1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(4-methoxyphenyl)methyl]-5-phenyl-pyrazole-3-carboxamide

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(4-methoxyphenyl)methyl]-5-phenyl-pyrazole-3-carboxamide Openeye Name: 1-[(3S)-1,1-dioxothiolan-3-yl]-N-[(4-methoxyphenyl)methyl]-5-phenyl-pyrazole-3-carboxamide CAS Name: 1-[(3S)-1,1-dioxo-3-thiolanyl]-N-[(4-methoxyphenyl)methyl]-5-phenyl-3-pyrazolecarboxamide IUPAC Name: 1-[(3S)-1,1-dioxothiolan-3-yl]-N-[(4-methoxyphenyl)methyl]-5-phenylpyrazole-3-carboxamide Traditional Name: 1-[(3S)-1,1-diketothiolan-3-yl]-N-p-anisyl-5-phenyl-pyrazole-3-carboxamide Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2=NN(C(=C2)C3=CC=CC=C3)C4CCS(=O)(=O)C4

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C2=NN(C(=C2)C3=CC=CC=C3)[C@H]4CCS(=O)(=O)C4

InChI

InChI=1S/C22H23N3O4S/c1-29-19-9-7-16(8-10-19)14-23-22(26)20-13-21(17-5-3-2-4-6-17)25(24-20)18-11-12-30(27,28)15-18/h2-10,13,18H,11-12,14-15H2,1H3,(H,23,26)/t18-/m0/s1