3-chloranyl-N-[2-(4-methylphenyl)carbonyl-1-benzofuran-3-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-(4-methylphenyl)carbonyl-1-benzofuran-3-yl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-(4-methylbenzoyl)benzofuran-3-yl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-[(4-methylphenyl)-oxomethyl]-3-benzofuranyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(2-p-toluoylbenzofuran-3-yl)benzothiophene-2-carboxamide Formula: C25H16ClNO3S MolecularWeight: 445.91744

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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=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C(C3=CC=CC=C3O2)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C25H16ClNO3S/c1-14-10-12-15(13-11-14)22(28)23-21(16-6-2-4-8-18(16)30-23)27-25(29)24-20(26)17-7-3-5-9-19(17)31-24/h2-13H,1H3,(H,27,29)