3-[6-bromanyl-2-fluoranyl-3-[(5-methyl-4-oxidanylidene-2-sulfanylidene-pyrimidin-1-yl)methyl]phenoxy]-5-chloranyl-benzenecarbonitrile

Systemtic Name: 3-[6-bromanyl-2-fluoranyl-3-[(5-methyl-4-oxidanylidene-2-sulfanylidene-pyrimidin-1-yl)methyl]phenoxy]-5-chloranyl-benzenecarbonitrile Openeye Name: 3-[6-bromo-2-fluoro-3-[(5-methyl-4-oxo-2-thioxo-pyrimidin-1-yl)methyl]phenoxy]-5-chloro-benzonitrile CAS Name: 3-[6-bromo-2-fluoro-3-[(5-methyl-4-oxo-2-sulfanylidene-1-pyrimidinyl)methyl]phenoxy]-5-chlorobenzonitrile IUPAC Name: 3-[6-bromo-2-fluoro-3-[(5-methyl-4-oxo-2-sulfanylidenepyrimidin-1-yl)methyl]phenoxy]-5-chlorobenzonitrile Traditional Name: 3-[6-bromo-2-fluoro-3-[(4-keto-5-methyl-2-thioxo-pyrimidin-1-yl)methyl]phenoxy]-5-chloro-benzonitrile Formula: C19H12BrClFN3O2S MolecularWeight: 480.737883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=S)NC1=O)CC2=C(C(=C(C=C2)Br)OC3=CC(=CC(=C3)C#N)Cl)F

Isomeric SMILES

CC1=CN(C(=S)NC1=O)CC2=C(C(=C(C=C2)Br)OC3=CC(=CC(=C3)C#N)Cl)F

InChI

InChI=1S/C19H12BrClFN3O2S/c1-10-8-25(19(28)24-18(10)26)9-12-2-3-15(20)17(16(12)22)27-14-5-11(7-23)4-13(21)6-14/h2-6,8H,9H2,1H3,(H,24,26,28)