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

Systemtic Name: 5-chloranyl-N-[2-(4-ethoxyphenyl)carbonyl-1-benzofuran-3-yl]-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[2-(4-ethoxybenzoyl)benzofuran-3-yl]-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[2-[(4-ethoxyphenyl)-oxomethyl]-3-benzofuranyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[2-(4-ethoxybenzoyl)-1-benzofuran-3-yl]-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[2-(4-ethoxybenzoyl)benzofuran-3-yl]-2-(methylthio)pyrimidine-4-carboxamide Formula: C23H18ClN3O4S MolecularWeight: 467.92472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C2=C(C3=CC=CC=C3O2)NC(=O)C4=NC(=NC=C4Cl)SC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)C2=C(C3=CC=CC=C3O2)NC(=O)C4=NC(=NC=C4Cl)SC

InChI

InChI=1S/C23H18ClN3O4S/c1-3-30-14-10-8-13(9-11-14)20(28)21-18(15-6-4-5-7-17(15)31-21)26-22(29)19-16(24)12-25-23(27-19)32-2/h4-12H,3H2,1-2H3,(H,26,29)