N-[[4-(4-chlorophenyl)phenyl]methyl]-N-(2-diethylaminoethyl)-2-[2-[(4-fluorophenyl)methylsulfanyl]-5-(hydroxymethyl)-4-oxidanylidene-pyrimidin-1-yl]ethanamide

Systemtic Name: N-[[4-(4-chlorophenyl)phenyl]methyl]-N-(2-diethylaminoethyl)-2-[2-[(4-fluorophenyl)methylsulfanyl]-5-(hydroxymethyl)-4-oxidanylidene-pyrimidin-1-yl]ethanamide Openeye Name: N-[[4-(4-chlorophenyl)phenyl]methyl]-N-(2-diethylaminoethyl)-2-[2-[(4-fluorophenyl)methylsulfanyl]-5-(hydroxymethyl)-4-oxo-pyrimidin-1-yl]acetamide CAS Name: N-[[4-(4-chlorophenyl)phenyl]methyl]-N-(2-diethylaminoethyl)-2-[2-[(4-fluorophenyl)methylthio]-5-(hydroxymethyl)-4-oxo-1-pyrimidinyl]acetamide IUPAC Name: N-[[4-(4-chlorophenyl)phenyl]methyl]-N-(2-diethylaminoethyl)-2-[2-[(4-fluorophenyl)methylsulfanyl]-5-(hydroxymethyl)-4-oxopyrimidin-1-yl]acetamide Traditional Name: N-[4-(4-chlorophenyl)benzyl]-N-(2-diethylaminoethyl)-2-[2-[(4-fluorobenzyl)thio]-4-keto-5-methylol-pyrimidin-1-yl]acetamide Formula: C33H36ClFN4O3S MolecularWeight: 623.180343

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(CC1=CC=C(C=C1)C2=CC=C(C=C2)Cl)C(=O)CN3C=C(C(=O)N=C3SCC4=CC=C(C=C4)F)CO

Isomeric SMILES

CCN(CC)CCN(CC1=CC=C(C=C1)C2=CC=C(C=C2)Cl)C(=O)CN3C=C(C(=O)N=C3SCC4=CC=C(C=C4)F)CO

InChI

InChI=1S/C33H36ClFN4O3S/c1-3-37(4-2)17-18-38(19-24-5-9-26(10-6-24)27-11-13-29(34)14-12-27)31(41)21-39-20-28(22-40)32(42)36-33(39)43-23-25-7-15-30(35)16-8-25/h5-16,20,40H,3-4,17-19,21-23H2,1-2H3