1-[5-(hydroxymethyl)-4-(4-methylphenyl)sulfanyl-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[5-(hydroxymethyl)-4-(4-methylphenyl)sulfanyl-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[5-(hydroxymethyl)-4-(p-tolylsulfanyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[5-(hydroxymethyl)-4-[(4-methylphenyl)thio]-2-oxolanyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[5-(hydroxymethyl)-4-(4-methylphenyl)sulfanyloxolan-2-yl]-5-methylpyrimidine-2,4-dione Traditional Name: 5-methyl-1-[5-methylol-4-(p-tolylthio)tetrahydrofuran-2-yl]pyrimidine-2,4-quinone Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2CC(OC2CO)N3C=C(C(=O)NC3=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2CC(OC2CO)N3C=C(C(=O)NC3=O)C

InChI

InChI=1S/C17H20N2O4S/c1-10-3-5-12(6-4-10)24-14-7-15(23-13(14)9-20)19-8-11(2)16(21)18-17(19)22/h3-6,8,13-15,20H,7,9H2,1-2H3,(H,18,21,22)