N-[(4-fluorophenyl)methyl]-2-(furan-2-yl)-4-methyl-6-methylsulfanyl-pyrimidine-5-carboxamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-(furan-2-yl)-4-methyl-6-methylsulfanyl-pyrimidine-5-carboxamide Openeye Name: N-[(4-fluorophenyl)methyl]-2-(2-furyl)-4-methyl-6-methylsulfanyl-pyrimidine-5-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-2-(2-furanyl)-4-methyl-6-(methylthio)-5-pyrimidinecarboxamide IUPAC Name: N-[(4-fluorophenyl)methyl]-2-(furan-2-yl)-4-methyl-6-methylsulfanylpyrimidine-5-carboxamide Traditional Name: N-(4-fluorobenzyl)-2-(2-furyl)-4-methyl-6-(methylthio)pyrimidine-5-carboxamide Formula: C18H16FN3O2S MolecularWeight: 357.401943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CO2)SC)C(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CO2)SC)C(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H16FN3O2S/c1-11-15(17(23)20-10-12-5-7-13(19)8-6-12)18(25-2)22-16(21-11)14-4-3-9-24-14/h3-9H,10H2,1-2H3,(H,20,23)