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

Systemtic Name: 4-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]-N-(4-phenoxyphenyl)benzamide Openeye Name: 4-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]-N-(4-phenoxyphenyl)benzamide CAS Name: 4-[2-[(4-fluorophenyl)methylthio]-4-oxo-5-(5-pyrimidinylmethyl)-1-pyrimidinyl]-N-(4-phenoxyphenyl)benzamide IUPAC Name: 4-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]-N-(4-phenoxyphenyl)benzamide Traditional Name: 4-[2-[(4-fluorobenzyl)thio]-4-keto-5-(5-pyrimidylmethyl)pyrimidin-1-yl]-N-(4-phenoxyphenyl)benzamide Formula: C35H26FN5O3S MolecularWeight: 615.676043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)N4C=C(C(=O)N=C4SCC5=CC=C(C=C5)F)CC6=CN=CN=C6

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)N4C=C(C(=O)N=C4SCC5=CC=C(C=C5)F)CC6=CN=CN=C6

InChI

InChI=1S/C35H26FN5O3S/c36-28-10-6-24(7-11-28)22-45-35-40-34(43)27(18-25-19-37-23-38-20-25)21-41(35)30-14-8-26(9-15-30)33(42)39-29-12-16-32(17-13-29)44-31-4-2-1-3-5-31/h1-17,19-21,23H,18,22H2,(H,39,42)