2-[4,6-bis(ethylsulfanyl)pyrimidin-5-yl]tetradecanethioamide

Systemtic Name: 2-[4,6-bis(ethylsulfanyl)pyrimidin-5-yl]tetradecanethioamide Openeye Name: 2-[4,6-bis(ethylsulfanyl)pyrimidin-5-yl]tetradecanethioamide CAS Name: 2-[4,6-bis(ethylthio)-5-pyrimidinyl]tetradecanethioamide IUPAC Name: 2-[4,6-bis(ethylsulfanyl)pyrimidin-5-yl]tetradecanethioamide Traditional Name: 2-[4,6-bis(ethylthio)pyrimidin-5-yl]thiomyristamide Formula: C22H39N3S3 MolecularWeight: 441.76016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C1=C(N=CN=C1SCC)SCC)C(=S)N

Isomeric SMILES

CCCCCCCCCCCCC(C1=C(N=CN=C1SCC)SCC)C(=S)N

InChI

InChI=1S/C22H39N3S3/c1-4-7-8-9-10-11-12-13-14-15-16-18(20(23)26)19-21(27-5-2)24-17-25-22(19)28-6-3/h17-18H,4-16H2,1-3H3,(H2,23,26)