N-[(4-methylsulfanylphenyl)methyl]-4-(4-phenoxypyrimidin-2-yl)benzamide

Systemtic Name: N-[(4-methylsulfanylphenyl)methyl]-4-(4-phenoxypyrimidin-2-yl)benzamide Openeye Name: N-[(4-methylsulfanylphenyl)methyl]-4-(4-phenoxypyrimidin-2-yl)benzamide CAS Name: N-[[4-(methylthio)phenyl]methyl]-4-(4-phenoxy-2-pyrimidinyl)benzamide IUPAC Name: N-[(4-methylsulfanylphenyl)methyl]-4-(4-phenoxypyrimidin-2-yl)benzamide Traditional Name: N-[4-(methylthio)benzyl]-4-(4-phenoxypyrimidin-2-yl)benzamide Formula: C25H21N3O2S MolecularWeight: 427.51814

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)C3=NC=CC(=N3)OC4=CC=CC=C4

Isomeric SMILES

CSC1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)C3=NC=CC(=N3)OC4=CC=CC=C4

InChI

InChI=1S/C25H21N3O2S/c1-31-22-13-7-18(8-14-22)17-27-25(29)20-11-9-19(10-12-20)24-26-16-15-23(28-24)30-21-5-3-2-4-6-21/h2-16H,17H2,1H3,(H,27,29)