2-(2-diethylaminoethylsulfanylmethyl)-5-oxidanyl-pyran-4-one hydrochloride

Systemtic Name: 2-(2-diethylaminoethylsulfanylmethyl)-5-oxidanyl-pyran-4-one hydrochloride Openeye Name: 2-(2-diethylaminoethylsulfanylmethyl)-5-hydroxy-pyran-4-one hydrochloride CAS Name: 2-[(2-diethylaminoethylthio)methyl]-5-hydroxy-4-pyranone hydrochloride IUPAC Name: 2-(2-diethylaminoethylsulfanylmethyl)-5-hydroxypyran-4-one hydrochloride Traditional Name: 2-[(2-diethylaminoethylthio)methyl]-5-hydroxy-pyran-4-one hydrochloride Formula: C12H20ClNO3S MolecularWeight: 293.8101

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSCC1=CC(=O)C(=CO1)O.Cl

Isomeric SMILES

CCN(CC)CCSCC1=CC(=O)C(=CO1)O.Cl

InChI

InChI=1S/C12H19NO3S.ClH/c1-3-13(4-2)5-6-17-9-10-7-11(14)12(15)8-16-10;/h7-8,15H,3-6,9H2,1-2H3;1H