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

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-5-cyclopropyl-N-(3-ethanoylphenyl)pyrazole-3-carboxamide Openeye Name: N-(3-acetylphenyl)-5-cyclopropyl-1-[(3S)-1,1-dioxothiolan-3-yl]pyrazole-3-carboxamide CAS Name: N-(3-acetylphenyl)-5-cyclopropyl-1-[(3S)-1,1-dioxo-3-thiolanyl]-3-pyrazolecarboxamide IUPAC Name: N-(3-acetylphenyl)-5-cyclopropyl-1-[(3S)-1,1-dioxothiolan-3-yl]pyrazole-3-carboxamide Traditional Name: N-(3-acetylphenyl)-5-cyclopropyl-1-[(3S)-1,1-diketothiolan-3-yl]pyrazole-3-carboxamide Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C2=NN(C(=C2)C3CC3)C4CCS(=O)(=O)C4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)C2=NN(C(=C2)C3CC3)[C@H]4CCS(=O)(=O)C4

InChI

InChI=1S/C19H21N3O4S/c1-12(23)14-3-2-4-15(9-14)20-19(24)17-10-18(13-5-6-13)22(21-17)16-7-8-27(25,26)11-16/h2-4,9-10,13,16H,5-8,11H2,1H3,(H,20,24)/t16-/m0/s1