3-(dimethylaminomethyl)-N-[2-[4-methanoyl-3-(oxidanylcarbamothioyl)phenoxy]ethyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-(dimethylaminomethyl)-N-[2-[4-methanoyl-3-(oxidanylcarbamothioyl)phenoxy]ethyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(dimethylaminomethyl)-N-[2-[4-formyl-3-(hydroxycarbamothioyl)phenoxy]ethyl]benzofuran-2-carboxamide CAS Name: 3-(dimethylaminomethyl)-N-[2-[4-formyl-3-[(hydroxyamino)-sulfanylidenemethyl]phenoxy]ethyl]-2-benzofurancarboxamide IUPAC Name: 3-(dimethylaminomethyl)-N-[2-[4-formyl-3-(hydroxycarbamothioyl)phenoxy]ethyl]-1-benzofuran-2-carboxamide Traditional Name: 3-(dimethylaminomethyl)-N-[2-[4-formyl-3-(hydroxythiocarbamoyl)phenoxy]ethyl]coumarilamide Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C(OC2=CC=CC=C21)C(=O)NCCOC3=CC(=C(C=C3)C=O)C(=S)NO

Isomeric SMILES

CN(C)CC1=C(OC2=CC=CC=C21)C(=O)NCCOC3=CC(=C(C=C3)C=O)C(=S)NO

InChI

InChI=1S/C22H23N3O5S/c1-25(2)12-18-16-5-3-4-6-19(16)30-20(18)21(27)23-9-10-29-15-8-7-14(13-26)17(11-15)22(31)24-28/h3-8,11,13,28H,9-10,12H2,1-2H3,(H,23,27)(H,24,31)