2-[2-fluoranyl-4-[(2R)-1-[(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)carbonyl]pyrrolidin-2-yl]phenyl]-2-methyl-propanenitrile

Systemtic Name: 2-[2-fluoranyl-4-[(2R)-1-[(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)carbonyl]pyrrolidin-2-yl]phenyl]-2-methyl-propanenitrile Openeye Name: 2-[2-fluoro-4-[(2R)-1-(4-oxo-2-thioxo-1H-pyrimidine-5-carbonyl)pyrrolidin-2-yl]phenyl]-2-methyl-propanenitrile CAS Name: 2-[2-fluoro-4-[(2R)-1-[oxo-(4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)methyl]-2-pyrrolidinyl]phenyl]-2-methylpropanenitrile IUPAC Name: 2-[2-fluoro-4-[(2R)-1-(4-oxo-2-sulfanylidene-1H-pyrimidine-5-carbonyl)pyrrolidin-2-yl]phenyl]-2-methylpropanenitrile Traditional Name: 2-[2-fluoro-4-[(2R)-1-(4-keto-2-thioxo-1H-pyrimidine-5-carbonyl)pyrrolidin-2-yl]phenyl]-2-methyl-propionitrile Formula: C19H19FN4O2S MolecularWeight: 386.443163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=C(C=C(C=C1)C2CCCN2C(=O)C3=CNC(=S)NC3=O)F

Isomeric SMILES

CC(C)(C#N)C1=C(C=C(C=C1)[C@H]2CCCN2C(=O)C3=CNC(=S)NC3=O)F

InChI

InChI=1S/C19H19FN4O2S/c1-19(2,10-21)13-6-5-11(8-14(13)20)15-4-3-7-24(15)17(26)12-9-22-18(27)23-16(12)25/h5-6,8-9,15H,3-4,7H2,1-2H3,(H2,22,23,25,27)/t15-/m1/s1