N-[4-[(4,6-dimethoxypyrimidin-2-yl)methylsulfanyl]phenyl]-4-phenyl-benzamide

Systemtic Name: N-[4-[(4,6-dimethoxypyrimidin-2-yl)methylsulfanyl]phenyl]-4-phenyl-benzamide Openeye Name: N-[4-[(4,6-dimethoxypyrimidin-2-yl)methylsulfanyl]phenyl]-4-phenyl-benzamide CAS Name: N-[4-[(4,6-dimethoxy-2-pyrimidinyl)methylthio]phenyl]-4-phenylbenzamide IUPAC Name: N-[4-[(4,6-dimethoxypyrimidin-2-yl)methylsulfanyl]phenyl]-4-phenylbenzamide Traditional Name: N-[4-[(4,6-dimethoxypyrimidin-2-yl)methylthio]phenyl]-4-phenyl-benzamide Formula: C26H23N3O3S MolecularWeight: 457.54412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)CSC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=NC(=N1)CSC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H23N3O3S/c1-31-24-16-25(32-2)29-23(28-24)17-33-22-14-12-21(13-15-22)27-26(30)20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-16H,17H2,1-2H3,(H,27,30)