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

Systemtic Name: 3-decyl-6-(octylsulfanylmethyl)furo[2,3-d]pyrimidin-2-one Openeye Name: 3-decyl-6-(octylsulfanylmethyl)furo[2,3-d]pyrimidin-2-one CAS Name: 3-decyl-6-[(octylthio)methyl]-2-furo[2,3-d]pyrimidinone IUPAC Name: 3-decyl-6-(octylsulfanylmethyl)furo[2,3-d]pyrimidin-2-one Traditional Name: 3-decyl-6-[(octylthio)methyl]furo[2,3-d]pyrimidin-2-one Formula: C25H42N2O2S MolecularWeight: 434.67818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN1C=C2C=C(OC2=NC1=O)CSCCCCCCCC

Isomeric SMILES

CCCCCCCCCCN1C=C2C=C(OC2=NC1=O)CSCCCCCCCC

InChI

InChI=1S/C25H42N2O2S/c1-3-5-7-9-11-12-13-15-17-27-20-22-19-23(29-24(22)26-25(27)28)21-30-18-16-14-10-8-6-4-2/h19-20H,3-18,21H2,1-2H3