5-bromanyl-N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: 5-bromanyl-N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-3-methyl-1-benzofuran-2-carboxamide Openeye Name: 5-bromo-N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-3-methyl-benzofuran-2-carboxamide CAS Name: 5-bromo-N-[4-[(2,5-dimethylphenyl)thio]phenyl]-3-methyl-2-benzofurancarboxamide IUPAC Name: 5-bromo-N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-3-methyl-1-benzofuran-2-carboxamide Traditional Name: 5-bromo-N-[4-[(2,5-dimethylphenyl)thio]phenyl]-3-methyl-coumarilamide Formula: C24H20BrNO2S MolecularWeight: 466.3901

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)NC(=O)C3=C(C4=C(O3)C=CC(=C4)Br)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)NC(=O)C3=C(C4=C(O3)C=CC(=C4)Br)C

InChI

InChI=1S/C24H20BrNO2S/c1-14-4-5-15(2)22(12-14)29-19-9-7-18(8-10-19)26-24(27)23-16(3)20-13-17(25)6-11-21(20)28-23/h4-13H,1-3H3,(H,26,27)