5-(butylsulfonylmethylamino)pyrazol-3-one

Systemtic Name: 5-(butylsulfonylmethylamino)pyrazol-3-one Openeye Name: 5-(butylsulfonylmethylamino)pyrazol-3-one CAS Name: 5-(butylsulfonylmethylamino)-3-pyrazolone IUPAC Name: 5-(butylsulfonylmethylamino)pyrazol-3-one Traditional Name: 5-(butylsulfonylmethylamino)pyrazol-3-one Formula: C8H13N3O3S MolecularWeight: 231.27212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)CNC1=CC(=O)N=N1

Isomeric SMILES

CCCCS(=O)(=O)CNC1=CC(=O)N=N1

InChI

InChI=1S/C8H13N3O3S/c1-2-3-4-15(13,14)6-9-7-5-8(12)11-10-7/h5,9H,2-4,6H2,1H3