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

Systemtic Name: 3-octyl-6-(octylsulfanylmethyl)furo[2,3-d]pyrimidin-2-one Openeye Name: 3-octyl-6-(octylsulfanylmethyl)furo[2,3-d]pyrimidin-2-one CAS Name: 3-octyl-6-[(octylthio)methyl]-2-furo[2,3-d]pyrimidinone IUPAC Name: 3-octyl-6-(octylsulfanylmethyl)furo[2,3-d]pyrimidin-2-one Traditional Name: 3-octyl-6-[(octylthio)methyl]furo[2,3-d]pyrimidin-2-one Formula: C23H38N2O2S MolecularWeight: 406.62502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C=C2C=C(OC2=NC1=O)CSCCCCCCCC

Isomeric SMILES

CCCCCCCCN1C=C2C=C(OC2=NC1=O)CSCCCCCCCC

InChI

InChI=1S/C23H38N2O2S/c1-3-5-7-9-11-13-15-25-18-20-17-21(27-22(20)24-23(25)26)19-28-16-14-12-10-8-6-4-2/h17-18H,3-16,19H2,1-2H3