N-(3-cyanothiophen-2-yl)-3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(benzylsulfanylmethyl)-N-(3-cyano-2-thienyl)benzofuran-2-carboxamide CAS Name: N-(3-cyano-2-thiophenyl)-3-[(phenylmethylthio)methyl]-2-benzofurancarboxamide IUPAC Name: 3-(benzylsulfanylmethyl)-N-(3-cyanothiophen-2-yl)-1-benzofuran-2-carboxamide Traditional Name: 3-[(benzylthio)methyl]-N-(3-cyano-2-thienyl)coumarilamide Formula: C22H16N2O2S2 MolecularWeight: 404.50464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC2=C(OC3=CC=CC=C32)C(=O)NC4=C(C=CS4)C#N

Isomeric SMILES

C1=CC=C(C=C1)CSCC2=C(OC3=CC=CC=C32)C(=O)NC4=C(C=CS4)C#N

InChI

InChI=1S/C22H16N2O2S2/c23-12-16-10-11-28-22(16)24-21(25)20-18(17-8-4-5-9-19(17)26-20)14-27-13-15-6-2-1-3-7-15/h1-11H,13-14H2,(H,24,25)