2-[2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]-N-(3-pyridylmethyl)acetamide CAS Name: 2-[2-[(4-fluorophenyl)methylthio]-6-methyl-4-oxo-1H-pyrimidin-5-yl]-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-[2-[(4-fluorobenzyl)thio]-4-keto-6-methyl-1H-pyrimidin-5-yl]-N-(3-pyridylmethyl)acetamide Formula: C20H19FN4O2S MolecularWeight: 398.453863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC=C(C=C2)F)CC(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC=C(C=C2)F)CC(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C20H19FN4O2S/c1-13-17(9-18(26)23-11-15-3-2-8-22-10-15)19(27)25-20(24-13)28-12-14-4-6-16(21)7-5-14/h2-8,10H,9,11-12H2,1H3,(H,23,26)(H,24,25,27)