(2E)-2-[2-methoxy-4-[(3-oxidanyl-1-adamantyl)carbonylamino]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-N-pyridin-2-yl-1,3-dihydrobenzimidazole-5-carboxamide

Systemtic Name: (2E)-2-[2-methoxy-4-[(3-oxidanyl-1-adamantyl)carbonylamino]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-N-pyridin-2-yl-1,3-dihydrobenzimidazole-5-carboxamide Openeye Name: (2E)-2-[4-[(3-hydroxyadamantane-1-carbonyl)amino]-2-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene]-N-(2-pyridyl)-1,3-dihydrobenzimidazole-5-carboxamide CAS Name: (2E)-2-[4-[[(3-hydroxy-1-adamantyl)-oxomethyl]amino]-2-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene]-N-(2-pyridinyl)-1,3-dihydrobenzimidazole-5-carboxamide IUPAC Name: (2E)-2-[4-[(3-hydroxyadamantane-1-carbonyl)amino]-2-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene]-N-pyridin-2-yl-1,3-dihydrobenzimidazole-5-carboxamide Traditional Name: (2E)-2-[4-[(3-hydroxyadamantane-1-carbonyl)amino]-6-keto-2-methoxy-cyclohexa-2,4-dien-1-ylidene]-N-(2-pyridyl)-1,3-dihydrobenzimidazole-5-carboxamide Formula: C31H31N5O5 MolecularWeight: 553.60834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=O)C1=C2NC3=C(N2)C=C(C=C3)C(=O)NC4=CC=CC=N4)NC(=O)C56CC7CC(C5)CC(C7)(C6)O

Isomeric SMILES

COC\1=CC(=CC(=O)/C1=C/2\NC3=C(N2)C=C(C=C3)C(=O)NC4=CC=CC=N4)NC(=O)C56CC7CC(C5)CC(C7)(C6)O

InChI

InChI=1S/C31H31N5O5/c1-41-24-11-20(33-29(39)30-12-17-8-18(13-30)15-31(40,14-17)16-30)10-23(37)26(24)27-34-21-6-5-19(9-22(21)35-27)28(38)36-25-4-2-3-7-32-25/h2-7,9-11,17-18,34-35,40H,8,12-16H2,1H3,(H,33,39)(H,32,36,38)/b27-26-