2-propyl-5-(propylsulfinylmethyl)-1H-pyrazol-3-one

Systemtic Name: 2-propyl-5-(propylsulfinylmethyl)-1H-pyrazol-3-one Openeye Name: 2-propyl-5-(propylsulfinylmethyl)-1H-pyrazol-3-one CAS Name: 2-propyl-5-(propylsulfinylmethyl)-1H-pyrazol-3-one IUPAC Name: 2-propyl-5-(propylsulfinylmethyl)-1H-pyrazol-3-one Traditional Name: 2-propyl-5-(propylsulfinylmethyl)-3-pyrazolin-3-one Formula: C10H18N2O2S MolecularWeight: 230.32712

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=C(N1)CS(=O)CCC

Isomeric SMILES

CCCN1C(=O)C=C(N1)CS(=O)CCC

InChI

InChI=1S/C10H18N2O2S/c1-3-5-12-10(13)7-9(11-12)8-15(14)6-4-2/h7,11H,3-6,8H2,1-2H3