N-[1,1-bis(oxidanidyl)thiolan-3-yl]-1,3-diphenyl-pyrazole-4-carboxamide

Systemtic Name: N-[1,1-bis(oxidanidyl)thiolan-3-yl]-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-(1,1-dioxidothiolan-3-yl)-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-(1,1-dioxido-3-thiolanyl)-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-(1,1-dioxidothiolan-3-yl)-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-(1,1-dioxidothiolan-3-yl)-1,3-diphenyl-pyrazole-4-carboxamide Formula: C20H19N3O3S-2 MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(CC1NC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)([O-])[O-]

Isomeric SMILES

C1CS(CC1NC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)([O-])[O-]

InChI

InChI=1S/C20H21N3O3S/c24-20(21-16-11-12-27(25,26)14-16)18-13-23(17-9-5-2-6-10-17)22-19(18)15-7-3-1-4-8-15/h1-10,13,16,25-26H,11-12,14H2,(H,21,24)/p-2