4-[2,4-bis(fluoranyl)phenyl]-6-[(4-fluorophenyl)amino]-2-methylsulfanyl-pyrimidine-5-carbaldehyde

Systemtic Name: 4-[2,4-bis(fluoranyl)phenyl]-6-[(4-fluorophenyl)amino]-2-methylsulfanyl-pyrimidine-5-carbaldehyde Openeye Name: 4-(2,4-difluorophenyl)-6-(4-fluoroanilino)-2-methylsulfanyl-pyrimidine-5-carbaldehyde CAS Name: 4-(2,4-difluorophenyl)-6-(4-fluoroanilino)-2-(methylthio)-5-pyrimidinecarboxaldehyde IUPAC Name: 4-(2,4-difluorophenyl)-6-(4-fluoroanilino)-2-methylsulfanylpyrimidine-5-carbaldehyde Traditional Name: 4-(2,4-difluorophenyl)-6-(4-fluoroanilino)-2-(methylthio)pyrimidine-5-carbaldehyde Formula: C18H12F3N3OS MolecularWeight: 375.36759

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=N1)NC2=CC=C(C=C2)F)C=O)C3=C(C=C(C=C3)F)F

Isomeric SMILES

CSC1=NC(=C(C(=N1)NC2=CC=C(C=C2)F)C=O)C3=C(C=C(C=C3)F)F

InChI

InChI=1S/C18H12F3N3OS/c1-26-18-23-16(13-7-4-11(20)8-15(13)21)14(9-25)17(24-18)22-12-5-2-10(19)3-6-12/h2-9H,1H3,(H,22,23,24)