N-(4-acetamidophenyl)-1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-5-cyclopropyl-pyrazole-3-carboxamide

Systemtic Name: N-(4-acetamidophenyl)-1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-5-cyclopropyl-pyrazole-3-carboxamide Openeye Name: N-(4-acetamidophenyl)-5-cyclopropyl-1-[(3S)-1,1-dioxothiolan-3-yl]pyrazole-3-carboxamide CAS Name: N-(4-acetamidophenyl)-5-cyclopropyl-1-[(3S)-1,1-dioxo-3-thiolanyl]-3-pyrazolecarboxamide IUPAC Name: N-(4-acetamidophenyl)-5-cyclopropyl-1-[(3S)-1,1-dioxothiolan-3-yl]pyrazole-3-carboxamide Traditional Name: N-(4-acetamidophenyl)-5-cyclopropyl-1-[(3S)-1,1-diketothiolan-3-yl]pyrazole-3-carboxamide Formula: C19H22N4O4S MolecularWeight: 402.46738

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=NN(C(=C2)C3CC3)C4CCS(=O)(=O)C4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=NN(C(=C2)C3CC3)[C@H]4CCS(=O)(=O)C4

InChI

InChI=1S/C19H22N4O4S/c1-12(24)20-14-4-6-15(7-5-14)21-19(25)17-10-18(13-2-3-13)23(22-17)16-8-9-28(26,27)11-16/h4-7,10,13,16H,2-3,8-9,11H2,1H3,(H,20,24)(H,21,25)/t16-/m0/s1