2-chloranyl-2-(4-chloranyl-2-methyl-pyrimidin-5-yl)carbonyl-4-(4-fluoranylpyrimidin-5-yl)carbonyl-6-methyl-1-methylsulfanyl-pyrimidine-5-carbaldehyde

Systemtic Name: 2-chloranyl-2-(4-chloranyl-2-methyl-pyrimidin-5-yl)carbonyl-4-(4-fluoranylpyrimidin-5-yl)carbonyl-6-methyl-1-methylsulfanyl-pyrimidine-5-carbaldehyde Openeye Name: 2-chloro-2-(4-chloro-2-methyl-pyrimidine-5-carbonyl)-4-(4-fluoropyrimidine-5-carbonyl)-6-methyl-1-methylsulfanyl-pyrimidine-5-carbaldehyde CAS Name: 2-chloro-2-[(4-chloro-2-methyl-5-pyrimidinyl)-oxomethyl]-4-[(4-fluoro-5-pyrimidinyl)-oxomethyl]-6-methyl-1-(methylthio)-5-pyrimidinecarboxaldehyde IUPAC Name: 2-chloro-2-(4-chloro-2-methylpyrimidine-5-carbonyl)-4-(4-fluoropyrimidine-5-carbonyl)-6-methyl-1-methylsulfanylpyrimidine-5-carbaldehyde Traditional Name: 2-chloro-2-(4-chloro-2-methyl-pyrimidine-5-carbonyl)-4-(4-fluoropyrimidine-5-carbonyl)-6-methyl-1-(methylthio)pyrimidine-5-carbaldehyde Formula: C18H13Cl2FN6O3S MolecularWeight: 483.303623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(N1SC)(C(=O)C2=CN=C(N=C2Cl)C)Cl)C(=O)C3=CN=CN=C3F)C=O

Isomeric SMILES

CC1=C(C(=NC(N1SC)(C(=O)C2=CN=C(N=C2Cl)C)Cl)C(=O)C3=CN=CN=C3F)C=O

InChI

InChI=1S/C18H13Cl2FN6O3S/c1-8-12(6-28)13(14(29)10-4-22-7-24-17(10)21)26-18(20,27(8)31-3)15(30)11-5-23-9(2)25-16(11)19/h4-7H,1-3H3