2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-(3-iodanylphenyl)pyrazol-3-amine

Systemtic Name: 2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-(3-iodanylphenyl)pyrazol-3-amine Openeye Name: 2-(1,1-dioxothiolan-3-yl)-5-(3-iodophenyl)pyrazol-3-amine CAS Name: 2-(1,1-dioxo-3-thiolanyl)-5-(3-iodophenyl)-3-pyrazolamine IUPAC Name: 2-(1,1-dioxothiolan-3-yl)-5-(3-iodophenyl)pyrazol-3-amine Traditional Name: [2-(1,1-diketothiolan-3-yl)-5-(3-iodophenyl)pyrazol-3-yl]amine Formula: C13H14IN3O2S MolecularWeight: 403.23863

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1N2C(=CC(=N2)C3=CC(=CC=C3)I)N

Isomeric SMILES

C1CS(=O)(=O)CC1N2C(=CC(=N2)C3=CC(=CC=C3)I)N

InChI

InChI=1S/C13H14IN3O2S/c14-10-3-1-2-9(6-10)12-7-13(15)17(16-12)11-4-5-20(18,19)8-11/h1-3,6-7,11H,4-5,8,15H2