2-methyl-5-[2-(3-methylbutylsulfanyl)ethyl]-1H-pyrimidine-4,6-dione

Systemtic Name: 2-methyl-5-[2-(3-methylbutylsulfanyl)ethyl]-1H-pyrimidine-4,6-dione Openeye Name: 5-(2-isopentylsulfanylethyl)-2-methyl-1H-pyrimidine-4,6-dione CAS Name: 2-methyl-5-[2-(3-methylbutylthio)ethyl]-1H-pyrimidine-4,6-dione IUPAC Name: 2-methyl-5-[2-(3-methylbutylsulfanyl)ethyl]-1H-pyrimidine-4,6-dione Traditional Name: 5-[2-(isoamylthio)ethyl]-2-methyl-1H-pyrimidine-4,6-quinone Formula: C12H20N2O2S MolecularWeight: 256.3644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(C(=O)N1)CCSCCC(C)C

Isomeric SMILES

CC1=NC(=O)C(C(=O)N1)CCSCCC(C)C

InChI

InChI=1S/C12H20N2O2S/c1-8(2)4-6-17-7-5-10-11(15)13-9(3)14-12(10)16/h8,10H,4-7H2,1-3H3,(H,13,14,15,16)