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

Systemtic Name: 3-butyl-6-(hexylsulfanylmethyl)furo[2,3-d]pyrimidin-2-one Openeye Name: 3-butyl-6-(hexylsulfanylmethyl)furo[2,3-d]pyrimidin-2-one CAS Name: 3-butyl-6-[(hexylthio)methyl]-2-furo[2,3-d]pyrimidinone IUPAC Name: 3-butyl-6-(hexylsulfanylmethyl)furo[2,3-d]pyrimidin-2-one Traditional Name: 3-butyl-6-[(hexylthio)methyl]furo[2,3-d]pyrimidin-2-one Formula: C17H26N2O2S MolecularWeight: 322.46554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSCC1=CC2=CN(C(=O)N=C2O1)CCCC

Isomeric SMILES

CCCCCCSCC1=CC2=CN(C(=O)N=C2O1)CCCC

InChI

InChI=1S/C17H26N2O2S/c1-3-5-7-8-10-22-13-15-11-14-12-19(9-6-4-2)17(20)18-16(14)21-15/h11-12H,3-10,13H2,1-2H3