3-(2-hydroxyethyloxymethyl)-5-methyl-6-(3-methylphenyl)-1-sulfanyl-pyrimidine-2,4-dione

Systemtic Name: 3-(2-hydroxyethyloxymethyl)-5-methyl-6-(3-methylphenyl)-1-sulfanyl-pyrimidine-2,4-dione Openeye Name: 3-(2-hydroxyethoxymethyl)-5-methyl-6-(m-tolyl)-1-sulfanyl-pyrimidine-2,4-dione CAS Name: 3-(2-hydroxyethoxymethyl)-1-mercapto-5-methyl-6-(3-methylphenyl)pyrimidine-2,4-dione IUPAC Name: 3-(2-hydroxyethoxymethyl)-5-methyl-6-(3-methylphenyl)-1-sulfanylpyrimidine-2,4-dione Traditional Name: 3-(2-hydroxyethoxymethyl)-1-mercapto-5-methyl-6-(m-tolyl)pyrimidine-2,4-quinone Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(C(=O)N(C(=O)N2S)COCCO)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(C(=O)N(C(=O)N2S)COCCO)C

InChI

InChI=1S/C15H18N2O4S/c1-10-4-3-5-12(8-10)13-11(2)14(19)16(9-21-7-6-18)15(20)17(13)22/h3-5,8,18,22H,6-7,9H2,1-2H3