N-methyl-3-[(E)-2-[4-[[2-(phenylmethyl)-3H-benzimidazol-5-yl]amino]pyrimidin-5-yl]ethenyl]benzamide

Systemtic Name: N-methyl-3-[(E)-2-[4-[[2-(phenylmethyl)-3H-benzimidazol-5-yl]amino]pyrimidin-5-yl]ethenyl]benzamide Openeye Name: 3-[(E)-2-[4-[(2-benzyl-3H-benzimidazol-5-yl)amino]pyrimidin-5-yl]vinyl]-N-methyl-benzamide CAS Name: N-methyl-3-[(E)-2-[4-[[2-(phenylmethyl)-3H-benzimidazol-5-yl]amino]-5-pyrimidinyl]ethenyl]benzamide IUPAC Name: 3-[(E)-2-[4-[(2-benzyl-3H-benzimidazol-5-yl)amino]pyrimidin-5-yl]ethenyl]-N-methylbenzamide Traditional Name: 3-[(E)-2-[4-[(2-benzyl-3H-benzimidazol-5-yl)amino]pyrimidin-5-yl]vinyl]-N-methyl-benzamide Formula: C28H24N6O MolecularWeight: 460.52976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=CC(=C1)C=CC2=CN=CN=C2NC3=CC4=C(C=C3)N=C(N4)CC5=CC=CC=C5

Isomeric SMILES

CNC(=O)C1=CC=CC(=C1)/C=C/C2=CN=CN=C2NC3=CC4=C(C=C3)N=C(N4)CC5=CC=CC=C5

InChI

InChI=1S/C28H24N6O/c1-29-28(35)21-9-5-8-20(14-21)10-11-22-17-30-18-31-27(22)32-23-12-13-24-25(16-23)34-26(33-24)15-19-6-3-2-4-7-19/h2-14,16-18H,15H2,1H3,(H,29,35)(H,33,34)(H,30,31,32)/b11-10+