5-chloranyl-N-[2-(4-methylphenyl)carbonyl-1-benzofuran-3-yl]-2-propan-2-ylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[2-(4-methylphenyl)carbonyl-1-benzofuran-3-yl]-2-propan-2-ylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-isopropylsulfanyl-N-[2-(4-methylbenzoyl)benzofuran-3-yl]pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[2-[(4-methylphenyl)-oxomethyl]-3-benzofuranyl]-2-(propan-2-ylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]-2-propan-2-ylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(isopropylthio)-N-(2-p-toluoylbenzofuran-3-yl)pyrimidine-4-carboxamide Formula: C24H20ClN3O3S MolecularWeight: 465.9519

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C(C3=CC=CC=C3O2)NC(=O)C4=NC(=NC=C4Cl)SC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C(C3=CC=CC=C3O2)NC(=O)C4=NC(=NC=C4Cl)SC(C)C

InChI

InChI=1S/C24H20ClN3O3S/c1-13(2)32-24-26-12-17(25)20(28-24)23(30)27-19-16-6-4-5-7-18(16)31-22(19)21(29)15-10-8-14(3)9-11-15/h4-13H,1-3H3,(H,27,30)