7-[(4-methylphenyl)sulfanylmethyl]-2,3-dihydro-1,4-benzodioxin-6-amine

Systemtic Name: 7-[(4-methylphenyl)sulfanylmethyl]-2,3-dihydro-1,4-benzodioxin-6-amine Openeye Name: 7-(p-tolylsulfanylmethyl)-2,3-dihydro-1,4-benzodioxin-6-amine CAS Name: 7-[[(4-methylphenyl)thio]methyl]-2,3-dihydro-1,4-benzodioxin-6-amine IUPAC Name: 7-[(4-methylphenyl)sulfanylmethyl]-2,3-dihydro-1,4-benzodioxin-6-amine Traditional Name: [7-[(p-tolylthio)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl]amine Formula: C16H17NO2S MolecularWeight: 287.37668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=CC3=C(C=C2N)OCCO3

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=CC3=C(C=C2N)OCCO3

InChI

InChI=1S/C16H17NO2S/c1-11-2-4-13(5-3-11)20-10-12-8-15-16(9-14(12)17)19-7-6-18-15/h2-5,8-9H,6-7,10,17H2,1H3