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

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-5-cyclopropyl-N-(3,4-diethoxyphenyl)pyrazole-3-carboxamide Openeye Name: 5-cyclopropyl-N-(3,4-diethoxyphenyl)-1-[(3S)-1,1-dioxothiolan-3-yl]pyrazole-3-carboxamide CAS Name: 5-cyclopropyl-N-(3,4-diethoxyphenyl)-1-[(3S)-1,1-dioxo-3-thiolanyl]-3-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-N-(3,4-diethoxyphenyl)-1-[(3S)-1,1-dioxothiolan-3-yl]pyrazole-3-carboxamide Traditional Name: 5-cyclopropyl-N-(3,4-diethoxyphenyl)-1-[(3S)-1,1-diketothiolan-3-yl]pyrazole-3-carboxamide Formula: C21H27N3O5S MolecularWeight: 433.52118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O5S/c1-3-28-19-8-7-15(11-20(19)29-4-2)22-21(25)17-12-18(14-5-6-14)24(23-17)16-9-10-30(26,27)13-16/h7-8,11-12,14,16H,3-6,9-10,13H2,1-2H3,(H,22,25)/t16-/m0/s1