5-chloranyl-N-[2-[(4-methoxyphenyl)carbamoyl]-1-benzofuran-3-yl]-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[2-[(4-methoxyphenyl)carbamoyl]-1-benzofuran-3-yl]-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[2-[(4-methoxyphenyl)carbamoyl]benzofuran-3-yl]-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[2-[(4-methoxyanilino)-oxomethyl]-3-benzofuranyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[2-[(4-methoxyphenyl)carbamoyl]-1-benzofuran-3-yl]-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[2-[(4-methoxyphenyl)carbamoyl]benzofuran-3-yl]-2-(methylthio)pyrimidine-4-carboxamide Formula: C22H17ClN4O4S MolecularWeight: 468.91278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3O2)NC(=O)C4=NC(=NC=C4Cl)SC

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3O2)NC(=O)C4=NC(=NC=C4Cl)SC

InChI

InChI=1S/C22H17ClN4O4S/c1-30-13-9-7-12(8-10-13)25-21(29)19-17(14-5-3-4-6-16(14)31-19)26-20(28)18-15(23)11-24-22(27-18)32-2/h3-11H,1-2H3,(H,25,29)(H,26,28)