methyl 2-[(5-chloranylpyridin-2-yl)carbamoyl]-3-[(4-morpholin-4-ylcyclohexyl)carbonylamino]-1-benzofuran-5-carboxylate

Systemtic Name: methyl 2-[(5-chloranylpyridin-2-yl)carbamoyl]-3-[(4-morpholin-4-ylcyclohexyl)carbonylamino]-1-benzofuran-5-carboxylate Openeye Name: methyl 2-[(5-chloro-2-pyridyl)carbamoyl]-3-[(4-morpholinocyclohexanecarbonyl)amino]benzofuran-5-carboxylate CAS Name: 2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]-3-[[[4-(4-morpholinyl)cyclohexyl]-oxomethyl]amino]-5-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 2-[(5-chloropyridin-2-yl)carbamoyl]-3-[(4-morpholin-4-ylcyclohexanecarbonyl)amino]-1-benzofuran-5-carboxylate Traditional Name: 2-[(5-chloro-2-pyridyl)carbamoyl]-3-[(4-morpholinocyclohexanecarbonyl)amino]benzofuran-5-carboxylic acid methyl ester Formula: C27H29ClN4O6 MolecularWeight: 540.99536

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)OC(=C2NC(=O)C3CCC(CC3)N4CCOCC4)C(=O)NC5=NC=C(C=C5)Cl

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)OC(=C2NC(=O)C3CCC(CC3)N4CCOCC4)C(=O)NC5=NC=C(C=C5)Cl

InChI

InChI=1S/C27H29ClN4O6/c1-36-27(35)17-4-8-21-20(14-17)23(24(38-21)26(34)30-22-9-5-18(28)15-29-22)31-25(33)16-2-6-19(7-3-16)32-10-12-37-13-11-32/h4-5,8-9,14-16,19H,2-3,6-7,10-13H2,1H3,(H,31,33)(H,29,30,34)