tert-butyl 3-[[2-[(5-chloranylpyridin-2-yl)carbamoyl]-1-benzofuran-3-yl]carbamoylamino]propanoate

Systemtic Name: tert-butyl 3-[[2-[(5-chloranylpyridin-2-yl)carbamoyl]-1-benzofuran-3-yl]carbamoylamino]propanoate Openeye Name: tert-butyl 3-[[2-[(5-chloro-2-pyridyl)carbamoyl]benzofuran-3-yl]carbamoylamino]propanoate CAS Name: 3-[[[[2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]-3-benzofuranyl]amino]-oxomethyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[2-[(5-chloropyridin-2-yl)carbamoyl]-1-benzofuran-3-yl]carbamoylamino]propanoate Traditional Name: 3-[[2-[(5-chloro-2-pyridyl)carbamoyl]benzofuran-3-yl]carbamoylamino]propionic acid tert-butyl ester Formula: C22H23ClN4O5 MolecularWeight: 458.89482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCNC(=O)NC1=C(OC2=CC=CC=C21)C(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)CCNC(=O)NC1=C(OC2=CC=CC=C21)C(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C22H23ClN4O5/c1-22(2,3)32-17(28)10-11-24-21(30)27-18-14-6-4-5-7-15(14)31-19(18)20(29)26-16-9-8-13(23)12-25-16/h4-9,12H,10-11H2,1-3H3,(H2,24,27,30)(H,25,26,29)