N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-1-(4-methylsulfanylphenyl)ethanamine

Systemtic Name: N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-1-(4-methylsulfanylphenyl)ethanamine Openeye Name: N-(2,3-dihydrobenzofuran-5-ylmethyl)-1-(4-methylsulfanylphenyl)ethanamine CAS Name: N-(2,3-dihydrobenzofuran-5-ylmethyl)-1-[4-(methylthio)phenyl]ethanamine IUPAC Name: N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-1-(4-methylsulfanylphenyl)ethanamine Traditional Name: coumaran-5-ylmethyl-[1-[4-(methylthio)phenyl]ethyl]amine Formula: C18H21NOS MolecularWeight: 299.43044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)SC)NCC2=CC3=C(C=C2)OCC3

Isomeric SMILES

CC(C1=CC=C(C=C1)SC)NCC2=CC3=C(C=C2)OCC3

InChI

InChI=1S/C18H21NOS/c1-13(15-4-6-17(21-2)7-5-15)19-12-14-3-8-18-16(11-14)9-10-20-18/h3-8,11,13,19H,9-10,12H2,1-2H3