3-[[3-methyl-2-(phenethylsulfanylmethyl)-1-benzofuran-4-yl]oxy]propan-1-amine

Systemtic Name: 3-[[3-methyl-2-(phenethylsulfanylmethyl)-1-benzofuran-4-yl]oxy]propan-1-amine Openeye Name: 3-[3-methyl-2-(phenethylsulfanylmethyl)benzofuran-4-yl]oxypropan-1-amine CAS Name: 3-[[3-methyl-2-[(phenethylthio)methyl]-4-benzofuranyl]oxy]-1-propanamine IUPAC Name: 3-[[3-methyl-2-(phenethylsulfanylmethyl)-1-benzofuran-4-yl]oxy]propan-1-amine Traditional Name: 3-[3-methyl-2-[(phenethylthio)methyl]benzofuran-4-yl]oxypropylamine Formula: C21H25NO2S MolecularWeight: 355.4937

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=CC=C2)OCCCN)CSCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(OC2=C1C(=CC=C2)OCCCN)CSCCC3=CC=CC=C3

InChI

InChI=1S/C21H25NO2S/c1-16-20(15-25-14-11-17-7-3-2-4-8-17)24-19-10-5-9-18(21(16)19)23-13-6-12-22/h2-5,7-10H,6,11-15,22H2,1H3