methyl 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: methyl 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: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C20H20N6O4 MolecularWeight: 408.4106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1NC(=C3C(=CC=NC3=O)NC(CO)C(=O)OC)N2)N4C=CN=C4

Isomeric SMILES

CC1=CC(=CC2=C1N/C(=C\3/C(=CC=NC3=O)NC(CO)C(=O)OC)/N2)N4C=CN=C4

InChI

InChI=1S/C20H20N6O4/c1-11-7-12(26-6-5-21-10-26)8-14-17(11)25-18(24-14)16-13(3-4-22-19(16)28)23-15(9-27)20(29)30-2/h3-8,10,15,23-25,27H,9H2,1-2H3/b18-16-