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

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

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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=CC=CC=C4O3)COC

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4O3)COC

InChI

InChI=1S/C25H23NO3S/c1-16-8-9-17(2)23(14-16)30-19-12-10-18(11-13-19)26-25(27)24-21(15-28-3)20-6-4-5-7-22(20)29-24/h4-14H,15H2,1-3H3,(H,26,27)