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

Systemtic Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-5-methoxy-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-5-methoxy-3-methyl-benzofuran-2-carboxamide CAS Name: N-[4-[(2,5-dimethylphenyl)thio]phenyl]-5-methoxy-3-methyl-2-benzofurancarboxamide IUPAC Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-5-methoxy-3-methyl-1-benzofuran-2-carboxamide Traditional Name: N-[4-[(2,5-dimethylphenyl)thio]phenyl]-5-methoxy-3-methyl-coumarilamide Formula: C25H23NO3S MolecularWeight: 417.52002

Click to see the large picture

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)OC)C

Isomeric SMILES

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

InChI

InChI=1S/C25H23NO3S/c1-15-5-6-16(2)23(13-15)30-20-10-7-18(8-11-20)26-25(27)24-17(3)21-14-19(28-4)9-12-22(21)29-24/h5-14H,1-4H3,(H,26,27)