N-[2-[2-(phenylmethyl)-5-sulfanyl-1-benzofuran-3-yl]ethyl]cyclopropanecarboxamide

Systemtic Name: N-[2-[2-(phenylmethyl)-5-sulfanyl-1-benzofuran-3-yl]ethyl]cyclopropanecarboxamide Openeye Name: N-[2-(2-benzyl-5-sulfanyl-benzofuran-3-yl)ethyl]cyclopropanecarboxamide CAS Name: N-[2-[5-mercapto-2-(phenylmethyl)-3-benzofuranyl]ethyl]cyclopropanecarboxamide IUPAC Name: N-[2-(2-benzyl-5-sulfanyl-1-benzofuran-3-yl)ethyl]cyclopropanecarboxamide Traditional Name: N-[2-(2-benzyl-5-mercapto-benzofuran-3-yl)ethyl]cyclopropanecarboxamide Formula: C21H21NO2S MolecularWeight: 351.46194

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NCCC2=C(OC3=C2C=C(C=C3)S)CC4=CC=CC=C4

Isomeric SMILES

C1CC1C(=O)NCCC2=C(OC3=C2C=C(C=C3)S)CC4=CC=CC=C4

InChI

InChI=1S/C21H21NO2S/c23-21(15-6-7-15)22-11-10-17-18-13-16(25)8-9-19(18)24-20(17)12-14-4-2-1-3-5-14/h1-5,8-9,13,15,25H,6-7,10-12H2,(H,22,23)