4-[[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]methyl]-N-methyl-benzamide Openeye Name: 4-[[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]methyl]-N-methyl-benzamide CAS Name: 4-[[2-[(4-fluorophenyl)methylthio]-4-oxo-5-(5-pyrimidinylmethyl)-1-pyrimidinyl]methyl]-N-methylbenzamide IUPAC Name: 4-[[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]methyl]-N-methylbenzamide Traditional Name: 4-[[2-[(4-fluorobenzyl)thio]-4-keto-5-(5-pyrimidylmethyl)pyrimidin-1-yl]methyl]-N-methyl-benzamide Formula: C25H22FN5O2S MolecularWeight: 475.537883

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN2C=C(C(=O)N=C2SCC3=CC=C(C=C3)F)CC4=CN=CN=C4

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN2C=C(C(=O)N=C2SCC3=CC=C(C=C3)F)CC4=CN=CN=C4

InChI

InChI=1S/C25H22FN5O2S/c1-27-23(32)20-6-2-17(3-7-20)13-31-14-21(10-19-11-28-16-29-12-19)24(33)30-25(31)34-15-18-4-8-22(26)9-5-18/h2-9,11-12,14,16H,10,13,15H2,1H3,(H,27,32)