ethyl (E)-3-[4-(methylamino)-2-methylsulfanyl-pyrimidin-5-yl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-(methylamino)-2-methylsulfanyl-pyrimidin-5-yl]prop-2-enoate Openeye Name: ethyl (E)-3-[4-(methylamino)-2-methylsulfanyl-pyrimidin-5-yl]prop-2-enoate CAS Name: (E)-3-[4-(methylamino)-2-(methylthio)-5-pyrimidinyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-(methylamino)-2-methylsulfanylpyrimidin-5-yl]prop-2-enoate Traditional Name: (E)-3-[4-(methylamino)-2-(methylthio)pyrimidin-5-yl]acrylic acid ethyl ester Formula: C11H15N3O2S MolecularWeight: 253.3207

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CN=C(N=C1NC)SC

Isomeric SMILES

CCOC(=O)/C=C/C1=CN=C(N=C1NC)SC

InChI

InChI=1S/C11H15N3O2S/c1-4-16-9(15)6-5-8-7-13-11(17-3)14-10(8)12-2/h5-7H,4H2,1-3H3,(H,12,13,14)/b6-5+