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

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-5-cyclopropyl-N-phenethyl-pyrazole-3-carboxamide Openeye Name: 5-cyclopropyl-1-[(3S)-1,1-dioxothiolan-3-yl]-N-phenethyl-pyrazole-3-carboxamide CAS Name: 5-cyclopropyl-1-[(3S)-1,1-dioxo-3-thiolanyl]-N-phenethyl-3-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-1-[(3S)-1,1-dioxothiolan-3-yl]-N-phenethylpyrazole-3-carboxamide Traditional Name: 5-cyclopropyl-1-[(3S)-1,1-diketothiolan-3-yl]-N-phenethyl-pyrazole-3-carboxamide Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=NN2C3CCS(=O)(=O)C3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1N2C(=CC(=N2)C(=O)NCCC3=CC=CC=C3)C4CC4

InChI

InChI=1S/C19H23N3O3S/c23-19(20-10-8-14-4-2-1-3-5-14)17-12-18(15-6-7-15)22(21-17)16-9-11-26(24,25)13-16/h1-5,12,15-16H,6-11,13H2,(H,20,23)/t16-/m0/s1