N-[1,1-bis(oxidanylidene)thian-4-yl]-1H-pyrazole-4-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thian-4-yl]-1H-pyrazole-4-carboxamide Openeye Name: N-(1,1-dioxothian-4-yl)-1H-pyrazole-4-carboxamide CAS Name: N-(1,1-dioxo-4-thianyl)-1H-pyrazole-4-carboxamide IUPAC Name: N-(1,1-dioxothian-4-yl)-1H-pyrazole-4-carboxamide Traditional Name: N-(1,1-diketothian-4-yl)-1H-pyrazole-4-carboxamide Formula: C9H13N3O3S MolecularWeight: 243.28282

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NC(=O)C2=CNN=C2

Isomeric SMILES

C1CS(=O)(=O)CCC1NC(=O)C2=CNN=C2

InChI

InChI=1S/C9H13N3O3S/c13-9(7-5-10-11-6-7)12-8-1-3-16(14,15)4-2-8/h5-6,8H,1-4H2,(H,10,11)(H,12,13)