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

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-5-cyclopropyl-N-[(4-methylphenyl)methyl]pyrazole-3-carboxamide Openeye Name: 5-cyclopropyl-1-[(3S)-1,1-dioxothiolan-3-yl]-N-(p-tolylmethyl)pyrazole-3-carboxamide CAS Name: 5-cyclopropyl-1-[(3S)-1,1-dioxo-3-thiolanyl]-N-[(4-methylphenyl)methyl]-3-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-1-[(3S)-1,1-dioxothiolan-3-yl]-N-[(4-methylphenyl)methyl]pyrazole-3-carboxamide Traditional Name: 5-cyclopropyl-1-[(3S)-1,1-diketothiolan-3-yl]-N-(4-methylbenzyl)pyrazole-3-carboxamide Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=NN(C(=C2)C3CC3)C4CCS(=O)(=O)C4

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=NN(C(=C2)C3CC3)[C@H]4CCS(=O)(=O)C4

InChI

InChI=1S/C19H23N3O3S/c1-13-2-4-14(5-3-13)11-20-19(23)17-10-18(15-6-7-15)22(21-17)16-8-9-26(24,25)12-16/h2-5,10,15-16H,6-9,11-12H2,1H3,(H,20,23)/t16-/m0/s1