ethyl 2-[[3-[(4-cyanophenyl)-(methylamino)methyl]-1-methyl-2H-benzimidazol-5-yl]oxycarbonyl-pyridin-2-yl-amino]ethanoate

Systemtic Name: ethyl 2-[[3-[(4-cyanophenyl)-(methylamino)methyl]-1-methyl-2H-benzimidazol-5-yl]oxycarbonyl-pyridin-2-yl-amino]ethanoate Openeye Name: ethyl 2-[[3-[(4-cyanophenyl)-(methylamino)methyl]-1-methyl-2H-benzimidazol-5-yl]oxycarbonyl-(2-pyridyl)amino]acetate CAS Name: 2-[[[3-[(4-cyanophenyl)-(methylamino)methyl]-1-methyl-2H-benzimidazol-5-yl]oxy-oxomethyl]-(2-pyridinyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[3-[(4-cyanophenyl)-(methylamino)methyl]-1-methyl-2H-benzimidazol-5-yl]oxycarbonyl-pyridin-2-ylamino]acetate Traditional Name: 2-[[3-[(4-cyanophenyl)-(methylamino)methyl]-1-methyl-2H-benzimidazol-5-yl]oxycarbonyl-(2-pyridyl)amino]acetic acid ethyl ester Formula: C27H28N6O4 MolecularWeight: 500.54902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1=CC=CC=N1)C(=O)OC2=CC3=C(C=C2)N(CN3C(C4=CC=C(C=C4)C#N)NC)C

Isomeric SMILES

CCOC(=O)CN(C1=CC=CC=N1)C(=O)OC2=CC3=C(C=C2)N(CN3C(C4=CC=C(C=C4)C#N)NC)C

InChI

InChI=1S/C27H28N6O4/c1-4-36-25(34)17-32(24-7-5-6-14-30-24)27(35)37-21-12-13-22-23(15-21)33(18-31(22)3)26(29-2)20-10-8-19(16-28)9-11-20/h5-15,26,29H,4,17-18H2,1-3H3