(E)-3-(2,4-dimethoxy-6-methyl-pyrimidin-5-yl)-N-(2-octadecylsulfanylethyl)prop-2-enamide

Systemtic Name: (E)-3-(2,4-dimethoxy-6-methyl-pyrimidin-5-yl)-N-(2-octadecylsulfanylethyl)prop-2-enamide Openeye Name: (E)-3-(2,4-dimethoxy-6-methyl-pyrimidin-5-yl)-N-(2-octadecylsulfanylethyl)prop-2-enamide CAS Name: (E)-3-(2,4-dimethoxy-6-methyl-5-pyrimidinyl)-N-[2-(octadecylthio)ethyl]-2-propenamide IUPAC Name: (E)-3-(2,4-dimethoxy-6-methylpyrimidin-5-yl)-N-(2-octadecylsulfanylethyl)prop-2-enamide Traditional Name: (E)-3-(2,4-dimethoxy-6-methyl-pyrimidin-5-yl)-N-[2-(stearylthio)ethyl]acrylamide Formula: C30H53N3O3S MolecularWeight: 535.82512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSCCNC(=O)C=CC1=C(N=C(N=C1OC)OC)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSCCNC(=O)/C=C/C1=C(N=C(N=C1OC)OC)C

InChI

InChI=1S/C30H53N3O3S/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-37-25-23-31-28(34)22-21-27-26(2)32-30(36-4)33-29(27)35-3/h21-22H,5-20,23-25H2,1-4H3,(H,31,34)/b22-21+