(phenylmethyl) 2-[[(3Z)-3-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-oxidanylidene-pyridin-4-yl]amino]-3-oxidanyl-propanoate

Systemtic Name: (phenylmethyl) 2-[[(3Z)-3-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-oxidanylidene-pyridin-4-yl]amino]-3-oxidanyl-propanoate Openeye Name: benzyl 3-hydroxy-2-[[(3Z)-3-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-oxo-4-pyridyl]amino]propanoate CAS Name: 3-hydroxy-2-[[(3Z)-3-[6-(1-imidazolyl)-4-methyl-1,3-dihydrobenzimidazol-2-ylidene]-2-oxo-4-pyridinyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-hydroxy-2-[[(3Z)-3-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-oxopyridin-4-yl]amino]propanoate Traditional Name: 3-hydroxy-2-[[(3Z)-3-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-keto-4-pyridyl]amino]propionic acid benzyl ester Formula: C26H24N6O4 MolecularWeight: 484.50656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1NC(=C3C(=CC=NC3=O)NC(CO)C(=O)OCC4=CC=CC=C4)N2)N5C=CN=C5

Isomeric SMILES

CC1=CC(=CC2=C1N/C(=C\3/C(=CC=NC3=O)NC(CO)C(=O)OCC4=CC=CC=C4)/N2)N5C=CN=C5

InChI

InChI=1S/C26H24N6O4/c1-16-11-18(32-10-9-27-15-32)12-20-23(16)31-24(30-20)22-19(7-8-28-25(22)34)29-21(13-33)26(35)36-14-17-5-3-2-4-6-17/h2-12,15,21,29-31,33H,13-14H2,1H3/b24-22-