4-(cyclopropylmethylamino)-6-(2-fluorophenyl)-2-methylsulfanyl-pyrimidine-5-carbaldehyde

Systemtic Name: 4-(cyclopropylmethylamino)-6-(2-fluorophenyl)-2-methylsulfanyl-pyrimidine-5-carbaldehyde Openeye Name: 4-(cyclopropylmethylamino)-6-(2-fluorophenyl)-2-methylsulfanyl-pyrimidine-5-carbaldehyde CAS Name: 4-(cyclopropylmethylamino)-6-(2-fluorophenyl)-2-(methylthio)-5-pyrimidinecarboxaldehyde IUPAC Name: 4-(cyclopropylmethylamino)-6-(2-fluorophenyl)-2-methylsulfanylpyrimidine-5-carbaldehyde Traditional Name: 4-(cyclopropylmethylamino)-6-(2-fluorophenyl)-2-(methylthio)pyrimidine-5-carbaldehyde Formula: C16H16FN3OS MolecularWeight: 317.381143

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=N1)NCC2CC2)C=O)C3=CC=CC=C3F

Isomeric SMILES

CSC1=NC(=C(C(=N1)NCC2CC2)C=O)C3=CC=CC=C3F

InChI

InChI=1S/C16H16FN3OS/c1-22-16-19-14(11-4-2-3-5-13(11)17)12(9-21)15(20-16)18-8-10-6-7-10/h2-5,9-10H,6-8H2,1H3,(H,18,19,20)