methyl 2-[(5-chloranylpyridin-2-yl)carbamoyl]-3-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]carbonylamino]-1-benzofuran-5-carboxylate

Systemtic Name: methyl 2-[(5-chloranylpyridin-2-yl)carbamoyl]-3-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]carbonylamino]-1-benzofuran-5-carboxylate Openeye Name: methyl 3-[[4-(tert-butoxycarbonylamino)cyclohexanecarbonyl]amino]-2-[(5-chloro-2-pyridyl)carbamoyl]benzofuran-5-carboxylate CAS Name: 2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]-3-[[[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]cyclohexyl]-oxomethyl]amino]-5-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 2-[(5-chloropyridin-2-yl)carbamoyl]-3-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexanecarbonyl]amino]-1-benzofuran-5-carboxylate Traditional Name: 3-[[4-(tert-butoxycarbonylamino)cyclohexanecarbonyl]amino]-2-[(5-chloro-2-pyridyl)carbamoyl]benzofuran-5-carboxylic acid methyl ester Formula: C28H31ClN4O7 MolecularWeight: 571.02134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCC(CC1)C(=O)NC2=C(OC3=C2C=C(C=C3)C(=O)OC)C(=O)NC4=NC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCC(CC1)C(=O)NC2=C(OC3=C2C=C(C=C3)C(=O)OC)C(=O)NC4=NC=C(C=C4)Cl

InChI

InChI=1S/C28H31ClN4O7/c1-28(2,3)40-27(37)31-18-9-5-15(6-10-18)24(34)33-22-19-13-16(26(36)38-4)7-11-20(19)39-23(22)25(35)32-21-12-8-17(29)14-30-21/h7-8,11-15,18H,5-6,9-10H2,1-4H3,(H,31,37)(H,33,34)(H,30,32,35)