1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-5-(phenylmethyl)-4-sulfanylidene-pyrimidin-2-one

Systemtic Name: 1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-5-(phenylmethyl)-4-sulfanylidene-pyrimidin-2-one Openeye Name: 5-benzyl-1-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-thioxo-pyrimidin-2-one CAS Name: 1-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-5-(phenylmethyl)-4-sulfanylidene-2-pyrimidinone IUPAC Name: 5-benzyl-1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-sulfanylidenepyrimidin-2-one Traditional Name: 5-benzyl-1-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-4-thioxo-pyrimidin-2-one Formula: C16H18N2O4S MolecularWeight: 334.39012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=C(C(=S)NC2=O)CC3=CC=CC=C3)CO)O

Isomeric SMILES

C1C(C(OC1N2C=C(C(=S)NC2=O)CC3=CC=CC=C3)CO)O

InChI

InChI=1S/C16H18N2O4S/c19-9-13-12(20)7-14(22-13)18-8-11(15(23)17-16(18)21)6-10-4-2-1-3-5-10/h1-5,8,12-14,19-20H,6-7,9H2,(H,17,21,23)