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

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-5-cyclopropyl-N-(4-ethoxyphenyl)pyrazole-3-carboxamide Openeye Name: 5-cyclopropyl-1-[(3S)-1,1-dioxothiolan-3-yl]-N-(4-ethoxyphenyl)pyrazole-3-carboxamide CAS Name: 5-cyclopropyl-1-[(3S)-1,1-dioxo-3-thiolanyl]-N-(4-ethoxyphenyl)-3-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-1-[(3S)-1,1-dioxothiolan-3-yl]-N-(4-ethoxyphenyl)pyrazole-3-carboxamide Traditional Name: 5-cyclopropyl-1-[(3S)-1,1-diketothiolan-3-yl]-N-p-phenetyl-pyrazole-3-carboxamide Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=NN(C(=C2)C3CC3)C4CCS(=O)(=O)C4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=NN(C(=C2)C3CC3)[C@H]4CCS(=O)(=O)C4

InChI

InChI=1S/C19H23N3O4S/c1-2-26-16-7-5-14(6-8-16)20-19(23)17-11-18(13-3-4-13)22(21-17)15-9-10-27(24,25)12-15/h5-8,11,13,15H,2-4,9-10,12H2,1H3,(H,20,23)/t15-/m0/s1