N2-(5-chloranylpyridin-2-yl)-N5,N5-dimethyl-3-[[4-(propan-2-ylamino)cyclohexyl]carbonylamino]-1-benzofuran-2,5-dicarboxamide hydrochloride

Systemtic Name: N2-(5-chloranylpyridin-2-yl)-N5,N5-dimethyl-3-[[4-(propan-2-ylamino)cyclohexyl]carbonylamino]-1-benzofuran-2,5-dicarboxamide hydrochloride Openeye Name: N2-(5-chloro-2-pyridyl)-3-[[4-(isopropylamino)cyclohexanecarbonyl]amino]-N5,N5-dimethyl-benzofuran-2,5-dicarboxamide hydrochloride CAS Name: N2-(5-chloro-2-pyridinyl)-N5,N5-dimethyl-3-[[oxo-[4-(propan-2-ylamino)cyclohexyl]methyl]amino]benzofuran-2,5-dicarboxamide hydrochloride IUPAC Name: 2-N-(5-chloropyridin-2-yl)-5-N,5-N-dimethyl-3-[[4-(propan-2-ylamino)cyclohexanecarbonyl]amino]-1-benzofuran-2,5-dicarboxamide hydrochloride Traditional Name: N-(5-chloro-2-pyridyl)-3-[[4-(isopropylamino)cyclohexanecarbonyl]amino]-N',N'-dimethyl-benzofuran-2,5-dicarboxamide hydrochloride Formula: C27H33Cl2N5O4 MolecularWeight: 562.48802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H32ClN5O4.ClH/c1-15(2)30-19-9-5-16(6-10-19)25(34)32-23-20-13-17(27(36)33(3)4)7-11-21(20)37-24(23)26(35)31-22-12-8-18(28)14-29-22;/h7-8,11-16,19,30H,5-6,9-10H2,1-4H3,(H,32,34)(H,29,31,35);1H