[2-[[4-[[(5-chloranylpyridin-2-yl)-[[5-(dimethylcarbamoyl)-1-benzofuran-2-yl]carbonyl]amino]carbamoyl]cyclohexyl]-methyl-amino]-2-oxidanylidene-ethyl] ethanoate

Systemtic Name: [2-[[4-[[(5-chloranylpyridin-2-yl)-[[5-(dimethylcarbamoyl)-1-benzofuran-2-yl]carbonyl]amino]carbamoyl]cyclohexyl]-methyl-amino]-2-oxidanylidene-ethyl] ethanoate Openeye Name: [2-[[4-[[(5-chloro-2-pyridyl)-[5-(dimethylcarbamoyl)benzofuran-2-carbonyl]amino]carbamoyl]cyclohexyl]-methyl-amino]-2-oxo-ethyl] acetate CAS Name: acetic acid [2-[[4-[[2-(5-chloro-2-pyridinyl)-2-[[5-[dimethylamino(oxo)methyl]-2-benzofuranyl]-oxomethyl]hydrazinyl]-oxomethyl]cyclohexyl]-methylamino]-2-oxoethyl] ester IUPAC Name: [2-[[4-[[(5-chloropyridin-2-yl)-[5-(dimethylcarbamoyl)-1-benzofuran-2-carbonyl]amino]carbamoyl]cyclohexyl]-methylamino]-2-oxoethyl] acetate Traditional Name: acetic acid [2-[[4-[[(5-chloro-2-pyridyl)-[5-(dimethylcarbamoyl)benzofuran-2-carbonyl]amino]carbamoyl]cyclohexyl]-methyl-amino]-2-keto-ethyl] ester Formula: C29H32ClN5O7 MolecularWeight: 598.04668

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(=O)N(C)C1CCC(CC1)C(=O)NN(C2=NC=C(C=C2)Cl)C(=O)C3=CC4=C(O3)C=CC(=C4)C(=O)N(C)C

Isomeric SMILES

CC(=O)OCC(=O)N(C)C1CCC(CC1)C(=O)NN(C2=NC=C(C=C2)Cl)C(=O)C3=CC4=C(O3)C=CC(=C4)C(=O)N(C)C

InChI

InChI=1S/C29H32ClN5O7/c1-17(36)41-16-26(37)34(4)22-9-5-18(6-10-22)27(38)32-35(25-12-8-21(30)15-31-25)29(40)24-14-20-13-19(28(39)33(2)3)7-11-23(20)42-24/h7-8,11-15,18,22H,5-6,9-10,16H2,1-4H3,(H,32,38)