(E)-4-(4-azanyl-6-methylsulfanyl-pyrimidin-2-yl)sulfanyl-N-methyl-N-phenyl-but-2-enamide

Systemtic Name: (E)-4-(4-azanyl-6-methylsulfanyl-pyrimidin-2-yl)sulfanyl-N-methyl-N-phenyl-but-2-enamide Openeye Name: (E)-4-(4-amino-6-methylsulfanyl-pyrimidin-2-yl)sulfanyl-N-methyl-N-phenyl-but-2-enamide CAS Name: (E)-4-[[4-amino-6-(methylthio)-2-pyrimidinyl]thio]-N-methyl-N-phenyl-2-butenamide IUPAC Name: (E)-4-(4-amino-6-methylsulfanylpyrimidin-2-yl)sulfanyl-N-methyl-N-phenylbut-2-enamide Traditional Name: (E)-4-[[4-amino-6-(methylthio)pyrimidin-2-yl]thio]-N-methyl-N-phenyl-but-2-enamide Formula: C16H18N4OS2 MolecularWeight: 346.47032

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)C=CCSC2=NC(=CC(=N2)SC)N

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)/C=C/CSC2=NC(=CC(=N2)SC)N

InChI

InChI=1S/C16H18N4OS2/c1-20(12-7-4-3-5-8-12)15(21)9-6-10-23-16-18-13(17)11-14(19-16)22-2/h3-9,11H,10H2,1-2H3,(H2,17,18,19)/b9-6+