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

Systemtic Name: 2-[[2-[[(3Z)-3-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-oxidanylidene-pyridin-4-yl]amino]-3-oxidanyl-propanoyl]amino]-3-phenyl-propanamide Openeye Name: 2-[[3-hydroxy-2-[[(3Z)-3-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-oxo-4-pyridyl]amino]propanoyl]amino]-3-phenyl-propanamide CAS Name: 2-[[3-hydroxy-2-[[(3Z)-3-[6-(1-imidazolyl)-4-methyl-1,3-dihydrobenzimidazol-2-ylidene]-2-oxo-4-pyridinyl]amino]-1-oxopropyl]amino]-3-phenylpropanamide IUPAC Name: 2-[[3-hydroxy-2-[[(3Z)-3-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-oxopyridin-4-yl]amino]propanoyl]amino]-3-phenylpropanamide Traditional Name: 2-[[3-hydroxy-2-[[(3Z)-3-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-keto-4-pyridyl]amino]propanoyl]amino]-3-phenyl-propionamide Formula: C28H28N8O4 MolecularWeight: 540.57312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1NC(=C3C(=CC=NC3=O)NC(CO)C(=O)NC(CC4=CC=CC=C4)C(=O)N)N2)N5C=CN=C5

Isomeric SMILES

CC1=CC(=CC2=C1N/C(=C\3/C(=CC=NC3=O)NC(CO)C(=O)NC(CC4=CC=CC=C4)C(=O)N)/N2)N5C=CN=C5

InChI

InChI=1S/C28H28N8O4/c1-16-11-18(36-10-9-30-15-36)13-20-24(16)35-26(33-20)23-19(7-8-31-28(23)40)32-22(14-37)27(39)34-21(25(29)38)12-17-5-3-2-4-6-17/h2-11,13,15,21-22,32-33,35,37H,12,14H2,1H3,(H2,29,38)(H,34,39)/b26-23-