2-[(2-methyl-5-methylsulfanyl-2,3-dihydro-1-benzofuran-7-yl)methyl]-2-phenyl-piperidin-1-amine

Systemtic Name: 2-[(2-methyl-5-methylsulfanyl-2,3-dihydro-1-benzofuran-7-yl)methyl]-2-phenyl-piperidin-1-amine Openeye Name: 2-[(2-methyl-5-methylsulfanyl-2,3-dihydrobenzofuran-7-yl)methyl]-2-phenyl-piperidin-1-amine CAS Name: 2-[[2-methyl-5-(methylthio)-2,3-dihydrobenzofuran-7-yl]methyl]-2-phenyl-1-piperidinamine IUPAC Name: 2-[(2-methyl-5-methylsulfanyl-2,3-dihydro-1-benzofuran-7-yl)methyl]-2-phenylpiperidin-1-amine Traditional Name: [2-[[2-methyl-5-(methylthio)coumaran-7-yl]methyl]-2-phenyl-piperidino]amine Formula: C22H28N2OS MolecularWeight: 368.53552

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC(=CC(=C2O1)CC3(CCCCN3N)C4=CC=CC=C4)SC

Isomeric SMILES

CC1CC2=CC(=CC(=C2O1)CC3(CCCCN3N)C4=CC=CC=C4)SC

InChI

InChI=1S/C22H28N2OS/c1-16-12-17-13-20(26-2)14-18(21(17)25-16)15-22(10-6-7-11-24(22)23)19-8-4-3-5-9-19/h3-5,8-9,13-14,16H,6-7,10-12,15,23H2,1-2H3