5-(2-chloroethyl)-1-[5-(hydroxymethyl)-4-oxidanyl-thiolan-2-yl]pyrimidine-2,4-dione

Systemtic Name: 5-(2-chloroethyl)-1-[5-(hydroxymethyl)-4-oxidanyl-thiolan-2-yl]pyrimidine-2,4-dione Openeye Name: 5-(2-chloroethyl)-1-[4-hydroxy-5-(hydroxymethyl)tetrahydrothiophen-2-yl]pyrimidine-2,4-dione CAS Name: 5-(2-chloroethyl)-1-[4-hydroxy-5-(hydroxymethyl)-2-thiolanyl]pyrimidine-2,4-dione IUPAC Name: 5-(2-chloroethyl)-1-[4-hydroxy-5-(hydroxymethyl)thiolan-2-yl]pyrimidine-2,4-dione Traditional Name: 5-(2-chloroethyl)-1-(4-hydroxy-5-methylol-tetrahydrothiophen-2-yl)pyrimidine-2,4-quinone Formula: C11H15ClN2O4S MolecularWeight: 306.7658

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(SC1N2C=C(C(=O)NC2=O)CCCl)CO)O

Isomeric SMILES

C1C(C(SC1N2C=C(C(=O)NC2=O)CCCl)CO)O

InChI

InChI=1S/C11H15ClN2O4S/c12-2-1-6-4-14(11(18)13-10(6)17)9-3-7(16)8(5-15)19-9/h4,7-9,15-16H,1-3,5H2,(H,13,17,18)