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

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-cyclopropyl-5-(4-methoxyphenyl)pyrazole-3-carboxamide Openeye Name: N-cyclopropyl-1-[(3S)-1,1-dioxothiolan-3-yl]-5-(4-methoxyphenyl)pyrazole-3-carboxamide CAS Name: N-cyclopropyl-1-[(3S)-1,1-dioxo-3-thiolanyl]-5-(4-methoxyphenyl)-3-pyrazolecarboxamide IUPAC Name: N-cyclopropyl-1-[(3S)-1,1-dioxothiolan-3-yl]-5-(4-methoxyphenyl)pyrazole-3-carboxamide Traditional Name: N-cyclopropyl-1-[(3S)-1,1-diketothiolan-3-yl]-5-(4-methoxyphenyl)pyrazole-3-carboxamide Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NN2C3CCS(=O)(=O)C3)C(=O)NC4CC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NN2[C@H]3CCS(=O)(=O)C3)C(=O)NC4CC4

InChI

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