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

Systemtic Name: 3-[[3-methyl-2-(phenethylsulfanylmethyl)-1-benzofuran-4-yl]oxy]-N-propan-2-yl-propan-1-amine Openeye Name: N-isopropyl-3-[3-methyl-2-(phenethylsulfanylmethyl)benzofuran-4-yl]oxy-propan-1-amine CAS Name: 3-[[3-methyl-2-[(phenethylthio)methyl]-4-benzofuranyl]oxy]-N-propan-2-yl-1-propanamine IUPAC Name: 3-[[3-methyl-2-(phenethylsulfanylmethyl)-1-benzofuran-4-yl]oxy]-N-propan-2-ylpropan-1-amine Traditional Name: isopropyl-[3-[3-methyl-2-[(phenethylthio)methyl]benzofuran-4-yl]oxypropyl]amine Formula: C24H31NO2S MolecularWeight: 397.57344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31NO2S/c1-18(2)25-14-8-15-26-21-11-7-12-22-24(21)19(3)23(27-22)17-28-16-13-20-9-5-4-6-10-20/h4-7,9-12,18,25H,8,13-17H2,1-3H3