3-methyl-7-(2-methylprop-2-enylsulfanylmethyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one

Systemtic Name: 3-methyl-7-(2-methylprop-2-enylsulfanylmethyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Openeye Name: 3-methyl-7-(2-methylallylsulfanylmethyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one CAS Name: 3-methyl-7-[(2-methylprop-2-enylthio)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one IUPAC Name: 3-methyl-7-(2-methylprop-2-enylsulfanylmethyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Traditional Name: 3-methyl-7-[(2-methylallylthio)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one Formula: C12H15N2OS2+ MolecularWeight: 267.3903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=[N+]1C(=O)C=C(N2)CSCC(=C)C

Isomeric SMILES

CC1=CSC2=[N+]1C(=O)C=C(N2)CSCC(=C)C

InChI

InChI=1S/C12H14N2OS2/c1-8(2)5-16-7-10-4-11(15)14-9(3)6-17-12(14)13-10/h4,6H,1,5,7H2,2-3H3/p+1