(E)-N-[4,6-bis(methylsulfanyl)pyrimidin-5-yl]octadec-9-enamide

Systemtic Name: (E)-N-[4,6-bis(methylsulfanyl)pyrimidin-5-yl]octadec-9-enamide Openeye Name: (E)-N-[4,6-bis(methylsulfanyl)pyrimidin-5-yl]octadec-9-enamide CAS Name: (E)-N-[4,6-bis(methylthio)-5-pyrimidinyl]-9-octadecenamide IUPAC Name: (E)-N-[4,6-bis(methylsulfanyl)pyrimidin-5-yl]octadec-9-enamide Traditional Name: (E)-N-[4,6-bis(methylthio)pyrimidin-5-yl]octadec-9-enamide Formula: C24H41N3OS2 MolecularWeight: 451.73184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NC1=C(N=CN=C1SC)SC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)NC1=C(N=CN=C1SC)SC

InChI

InChI=1S/C24H41N3OS2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(28)27-22-23(29-2)25-20-26-24(22)30-3/h11-12,20H,4-10,13-19H2,1-3H3,(H,27,28)/b12-11+