3-(methylsulfanylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1-benzofuran-2-carboxamide

Systemtic Name: 3-(methylsulfanylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1-benzofuran-2-carboxamide Openeye Name: 3-(methylsulfanylmethyl)-N-tetralin-1-yl-benzofuran-2-carboxamide CAS Name: 3-[(methylthio)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-2-benzofurancarboxamide IUPAC Name: 3-(methylsulfanylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1-benzofuran-2-carboxamide Traditional Name: 3-[(methylthio)methyl]-N-tetralin-1-yl-coumarilamide Formula: C21H21NO2S MolecularWeight: 351.46194

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=C(OC2=CC=CC=C21)C(=O)NC3CCCC4=CC=CC=C34

Isomeric SMILES

CSCC1=C(OC2=CC=CC=C21)C(=O)NC3CCCC4=CC=CC=C34

InChI

InChI=1S/C21H21NO2S/c1-25-13-17-16-10-4-5-12-19(16)24-20(17)21(23)22-18-11-6-8-14-7-2-3-9-15(14)18/h2-5,7,9-10,12,18H,6,8,11,13H2,1H3,(H,22,23)