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

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-5-cyclopropyl-N-(3-methoxyphenyl)pyrazole-3-carboxamide Openeye Name: 5-cyclopropyl-1-[(3S)-1,1-dioxothiolan-3-yl]-N-(3-methoxyphenyl)pyrazole-3-carboxamide CAS Name: 5-cyclopropyl-1-[(3S)-1,1-dioxo-3-thiolanyl]-N-(3-methoxyphenyl)-3-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-1-[(3S)-1,1-dioxothiolan-3-yl]-N-(3-methoxyphenyl)pyrazole-3-carboxamide Traditional Name: 5-cyclopropyl-1-[(3S)-1,1-diketothiolan-3-yl]-N-(3-methoxyphenyl)pyrazole-3-carboxamide Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C2=NN(C(=C2)C3CC3)C4CCS(=O)(=O)C4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)C2=NN(C(=C2)C3CC3)[C@H]4CCS(=O)(=O)C4

InChI

InChI=1S/C18H21N3O4S/c1-25-15-4-2-3-13(9-15)19-18(22)16-10-17(12-5-6-12)21(20-16)14-7-8-26(23,24)11-14/h2-4,9-10,12,14H,5-8,11H2,1H3,(H,19,22)/t14-/m0/s1