1-[1,3-bis(phenylmethoxy)propan-2-yloxymethyl]-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 1-[1,3-bis(phenylmethoxy)propan-2-yloxymethyl]-2-sulfanylidene-pyrimidin-4-one Openeye Name: 1-[[2-benzyloxy-1-(benzyloxymethyl)ethoxy]methyl]-2-thioxo-pyrimidin-4-one CAS Name: 1-[1,3-bis(phenylmethoxy)propan-2-yloxymethyl]-2-sulfanylidene-4-pyrimidinone IUPAC Name: 1-[1,3-bis(phenylmethoxy)propan-2-yloxymethyl]-2-sulfanylidenepyrimidin-4-one Traditional Name: 1-[[2-benzoxy-1-(benzoxymethyl)ethoxy]methyl]-2-thioxo-pyrimidin-4-one Formula: C22H24N2O4S MolecularWeight: 412.50196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC(COCC2=CC=CC=C2)OCN3C=CC(=O)NC3=S

Isomeric SMILES

C1=CC=C(C=C1)COCC(COCC2=CC=CC=C2)OCN3C=CC(=O)NC3=S

InChI

InChI=1S/C22H24N2O4S/c25-21-11-12-24(22(29)23-21)17-28-20(15-26-13-18-7-3-1-4-8-18)16-27-14-19-9-5-2-6-10-19/h1-12,20H,13-17H2,(H,23,25,29)