5-butyl-1,2-thiazol-4-one

Systemtic Name: 5-butyl-1,2-thiazol-4-one Openeye Name: 5-butylisothiazol-4-one CAS Name: 5-butyl-4-isothiazolone IUPAC Name: 5-butyl-1,2-thiazol-4-one Traditional Name: 5-butyl-2-isothiazolin-4-one Formula: C7H11NOS MolecularWeight: 157.23334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)C=NS1

Isomeric SMILES

CCCCC1C(=O)C=NS1

InChI

InChI=1S/C7H11NOS/c1-2-3-4-7-6(9)5-8-10-7/h5,7H,2-4H2,1H3