(E)-4-(4-azanyl-6-methylsulfanyl-pyrimidin-2-yl)sulfanyl-3-methyl-pent-2-enoic acid

Systemtic Name: (E)-4-(4-azanyl-6-methylsulfanyl-pyrimidin-2-yl)sulfanyl-3-methyl-pent-2-enoic acid Openeye Name: (E)-4-(4-amino-6-methylsulfanyl-pyrimidin-2-yl)sulfanyl-3-methyl-pent-2-enoic acid CAS Name: (E)-4-[[4-amino-6-(methylthio)-2-pyrimidinyl]thio]-3-methyl-2-pentenoic acid IUPAC Name: (E)-4-(4-amino-6-methylsulfanylpyrimidin-2-yl)sulfanyl-3-methylpent-2-enoic acid Traditional Name: (E)-4-[[4-amino-6-(methylthio)pyrimidin-2-yl]thio]-3-methyl-pent-2-enoic acid Formula: C11H15N3O2S2 MolecularWeight: 285.3857

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=CC(=O)O)C)SC1=NC(=CC(=N1)SC)N

Isomeric SMILES

CC(/C(=C/C(=O)O)/C)SC1=NC(=CC(=N1)SC)N

InChI

InChI=1S/C11H15N3O2S2/c1-6(4-10(15)16)7(2)18-11-13-8(12)5-9(14-11)17-3/h4-5,7H,1-3H3,(H,15,16)(H2,12,13,14)/b6-4+