N-[4-(furan-2-ylmethylsulfanyl)-6-methoxy-pyrimidin-5-yl]-2-hexyl-decanethioamide

Systemtic Name: N-[4-(furan-2-ylmethylsulfanyl)-6-methoxy-pyrimidin-5-yl]-2-hexyl-decanethioamide Openeye Name: N-[4-(2-furylmethylsulfanyl)-6-methoxy-pyrimidin-5-yl]-2-hexyl-decanethioamide CAS Name: N-[4-(2-furanylmethylthio)-6-methoxy-5-pyrimidinyl]-2-hexyldecanethioamide IUPAC Name: N-[4-(furan-2-ylmethylsulfanyl)-6-methoxypyrimidin-5-yl]-2-hexyldecanethioamide Traditional Name: N-[4-(2-furfurylthio)-6-methoxy-pyrimidin-5-yl]-2-hexyl-thiocapramide Formula: C26H41N3O2S2 MolecularWeight: 491.75264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCC)C(=S)NC1=C(N=CN=C1SCC2=CC=CO2)OC

Isomeric SMILES

CCCCCCCCC(CCCCCC)C(=S)NC1=C(N=CN=C1SCC2=CC=CO2)OC

InChI

InChI=1S/C26H41N3O2S2/c1-4-6-8-10-11-13-16-21(15-12-9-7-5-2)25(32)29-23-24(30-3)27-20-28-26(23)33-19-22-17-14-18-31-22/h14,17-18,20-21H,4-13,15-16,19H2,1-3H3,(H,29,32)