2-(3-chloranylpyridin-2-yl)-N-[6-ethynyl-2-oxidanylidene-4-(spiro[2.3]hexan-2-ylcarbamoyl)-3H-1-benzofuran-5-yl]-5-methoxy-pyrazole-3-carboxamide

Systemtic Name: 2-(3-chloranylpyridin-2-yl)-N-[6-ethynyl-2-oxidanylidene-4-(spiro[2.3]hexan-2-ylcarbamoyl)-3H-1-benzofuran-5-yl]-5-methoxy-pyrazole-3-carboxamide Openeye Name: 2-(3-chloro-2-pyridyl)-N-[6-ethynyl-2-oxo-4-(spiro[2.3]hexan-2-ylcarbamoyl)-3H-benzofuran-5-yl]-5-methoxy-pyrazole-3-carboxamide CAS Name: 2-(3-chloro-2-pyridinyl)-N-[6-ethynyl-2-oxo-4-[oxo-(2-spiro[2.3]hexanylamino)methyl]-3H-benzofuran-5-yl]-5-methoxy-3-pyrazolecarboxamide IUPAC Name: 2-(3-chloropyridin-2-yl)-N-[6-ethynyl-2-oxo-4-(spiro[2.3]hexan-2-ylcarbamoyl)-3H-1-benzofuran-5-yl]-5-methoxypyrazole-3-carboxamide Traditional Name: 2-(3-chloro-2-pyridyl)-N-[6-ethynyl-2-keto-4-(spiro[2.3]hexan-2-ylcarbamoyl)coumaran-5-yl]-5-methoxy-pyrazole-3-carboxamide Formula: C27H22ClN5O5 MolecularWeight: 531.94708

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN(C(=C1)C(=O)NC2=C(C3=C(C=C2C#C)OC(=O)C3)C(=O)NC4CC45CCC5)C6=C(C=CC=N6)Cl

Isomeric SMILES

COC1=NN(C(=C1)C(=O)NC2=C(C3=C(C=C2C#C)OC(=O)C3)C(=O)NC4CC45CCC5)C6=C(C=CC=N6)Cl

InChI

InChI=1S/C27H22ClN5O5/c1-3-14-10-18-15(11-21(34)38-18)22(26(36)30-19-13-27(19)7-5-8-27)23(14)31-25(35)17-12-20(37-2)32-33(17)24-16(28)6-4-9-29-24/h1,4,6,9-10,12,19H,5,7-8,11,13H2,2H3,(H,30,36)(H,31,35)