N-[(2,3-dimethoxyphenyl)methyl]-N-methylsulfonyl-5-(2-phenylethynyl)furan-2-carboxamide

Systemtic Name: N-[(2,3-dimethoxyphenyl)methyl]-N-methylsulfonyl-5-(2-phenylethynyl)furan-2-carboxamide Openeye Name: N-[(2,3-dimethoxyphenyl)methyl]-N-methylsulfonyl-5-(2-phenylethynyl)furan-2-carboxamide CAS Name: N-[(2,3-dimethoxyphenyl)methyl]-N-methylsulfonyl-5-(2-phenylethynyl)-2-furancarboxamide IUPAC Name: N-[(2,3-dimethoxyphenyl)methyl]-N-methylsulfonyl-5-(2-phenylethynyl)furan-2-carboxamide Traditional Name: N-mesyl-N-o-veratryl-5-(2-phenylethynyl)-2-furamide Formula: C23H21NO6S MolecularWeight: 439.48094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN(C(=O)C2=CC=C(O2)C#CC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC(=C1OC)CN(C(=O)C2=CC=C(O2)C#CC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C23H21NO6S/c1-28-20-11-7-10-18(22(20)29-2)16-24(31(3,26)27)23(25)21-15-14-19(30-21)13-12-17-8-5-4-6-9-17/h4-11,14-15H,16H2,1-3H3