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3,5-dimethylthian-4-one

Systemtic Name:	3,5-dimethylthian-4-one
Openeye Name:	3,5-dimethyltetrahydrothiopyran-4-one
CAS Name:	3,5-dimethyl-4-thianone
IUPAC Name:	3,5-dimethylthian-4-one
Traditional Name:	3,5-dimethyltetrahydrothiopyran-4-one
Formula:	C₇H₁₂OS
MolecularWeight:	144.23458

Descriptors Computed from Structure

Canonical SMILES:

CC1CSCC(C1=O)C

Isomeric SMILES

CC1CSCC(C1=O)C

InChI

InChI=1S/C7H12OS/c1-5-3-9-4-6(2)7(5)8/h5-6H,3-4H2,1-2H3