2-(4-azanyl-5-fluoranyl-pyrimidin-2-yl)sulfanyl-1-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]ethanone

Systemtic Name: 2-(4-azanyl-5-fluoranyl-pyrimidin-2-yl)sulfanyl-1-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Openeye Name: 2-(4-amino-5-fluoro-pyrimidin-2-yl)sulfanyl-1-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]ethanone CAS Name: 2-[(4-amino-5-fluoro-2-pyrimidinyl)thio]-1-[1-(2-methoxyethyl)-2,5-dimethyl-3-pyrrolyl]ethanone IUPAC Name: 2-(4-amino-5-fluoropyrimidin-2-yl)sulfanyl-1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]ethanone Traditional Name: 2-[(4-amino-5-fluoro-pyrimidin-2-yl)thio]-1-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Formula: C15H19FN4O2S MolecularWeight: 338.400363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCOC)C)C(=O)CSC2=NC=C(C(=N2)N)F

Isomeric SMILES

CC1=CC(=C(N1CCOC)C)C(=O)CSC2=NC=C(C(=N2)N)F

InChI

InChI=1S/C15H19FN4O2S/c1-9-6-11(10(2)20(9)4-5-22-3)13(21)8-23-15-18-7-12(16)14(17)19-15/h6-7H,4-5,8H2,1-3H3,(H2,17,18,19)