3-butyl-6-(octylsulfanylmethyl)furo[2,3-d]pyrimidin-2-one

Systemtic Name: 3-butyl-6-(octylsulfanylmethyl)furo[2,3-d]pyrimidin-2-one Openeye Name: 3-butyl-6-(octylsulfanylmethyl)furo[2,3-d]pyrimidin-2-one CAS Name: 3-butyl-6-[(octylthio)methyl]-2-furo[2,3-d]pyrimidinone IUPAC Name: 3-butyl-6-(octylsulfanylmethyl)furo[2,3-d]pyrimidin-2-one Traditional Name: 3-butyl-6-[(octylthio)methyl]furo[2,3-d]pyrimidin-2-one Formula: C19H30N2O2S MolecularWeight: 350.5187

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSCC1=CC2=CN(C(=O)N=C2O1)CCCC

Isomeric SMILES

CCCCCCCCSCC1=CC2=CN(C(=O)N=C2O1)CCCC

InChI

InChI=1S/C19H30N2O2S/c1-3-5-7-8-9-10-12-24-15-17-13-16-14-21(11-6-4-2)19(22)20-18(16)23-17/h13-14H,3-12,15H2,1-2H3