N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-5-ethoxy-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-5-ethoxy-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-5-ethoxy-3-methyl-benzofuran-2-carboxamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-5-ethoxy-3-methyl-2-benzofurancarboxamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-5-ethoxy-3-methyl-1-benzofuran-2-carboxamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-5-ethoxy-3-methyl-coumarilamide Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=C2C)C(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC(=C2C)C(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C22H22N2O3S/c1-3-26-18-8-9-20-19(12-18)15(2)21(27-20)22(25)24-10-11-28-14-17-7-5-4-6-16(17)13-23/h4-9,12H,3,10-11,14H2,1-2H3,(H,24,25)