1-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-phenethyl-5-phenyl-pyrazole-3-carboxamide

Systemtic Name: 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-phenethyl-5-phenyl-pyrazole-3-carboxamide Openeye Name: 1-(1,1-dioxothiolan-3-yl)-N-phenethyl-5-phenyl-pyrazole-3-carboxamide CAS Name: 1-(1,1-dioxo-3-thiolanyl)-N-phenethyl-5-phenyl-3-pyrazolecarboxamide IUPAC Name: 1-(1,1-dioxothiolan-3-yl)-N-phenethyl-5-phenylpyrazole-3-carboxamide Traditional Name: 1-(1,1-diketothiolan-3-yl)-N-phenethyl-5-phenyl-pyrazole-3-carboxamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1N2C(=CC(=N2)C(=O)NCCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CS(=O)(=O)CC1N2C(=CC(=N2)C(=O)NCCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N3O3S/c26-22(23-13-11-17-7-3-1-4-8-17)20-15-21(18-9-5-2-6-10-18)25(24-20)19-12-14-29(27,28)16-19/h1-10,15,19H,11-14,16H2,(H,23,26)