5-chloranyl-2-ethylsulfanyl-N-[2-(phenylcarbonyl)-1-benzofuran-3-yl]pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-ethylsulfanyl-N-[2-(phenylcarbonyl)-1-benzofuran-3-yl]pyrimidine-4-carboxamide Openeye Name: N-(2-benzoylbenzofuran-3-yl)-5-chloro-2-ethylsulfanyl-pyrimidine-4-carboxamide CAS Name: N-(2-benzoyl-3-benzofuranyl)-5-chloro-2-(ethylthio)-4-pyrimidinecarboxamide IUPAC Name: N-(2-benzoyl-1-benzofuran-3-yl)-5-chloro-2-ethylsulfanylpyrimidine-4-carboxamide Traditional Name: N-(2-benzoylbenzofuran-3-yl)-5-chloro-2-(ethylthio)pyrimidine-4-carboxamide Formula: C22H16ClN3O3S MolecularWeight: 437.89874

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C(=N1)C(=O)NC2=C(OC3=CC=CC=C32)C(=O)C4=CC=CC=C4)Cl

Isomeric SMILES

CCSC1=NC=C(C(=N1)C(=O)NC2=C(OC3=CC=CC=C32)C(=O)C4=CC=CC=C4)Cl

InChI

InChI=1S/C22H16ClN3O3S/c1-2-30-22-24-12-15(23)18(26-22)21(28)25-17-14-10-6-7-11-16(14)29-20(17)19(27)13-8-4-3-5-9-13/h3-12H,2H2,1H3,(H,25,28)