2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-5-methyl-aniline

Systemtic Name: 2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-5-methyl-aniline Openeye Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-5-methyl-aniline CAS Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-5-methylaniline IUPAC Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-5-methylaniline Traditional Name: [2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-5-methyl-phenyl]amine Formula: C16H16BrNO2S MolecularWeight: 366.27274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC2=CC3=C(C=C2Br)OCCO3)N

Isomeric SMILES

CC1=CC(=C(C=C1)SCC2=CC3=C(C=C2Br)OCCO3)N

InChI

InChI=1S/C16H16BrNO2S/c1-10-2-3-16(13(18)6-10)21-9-11-7-14-15(8-12(11)17)20-5-4-19-14/h2-3,6-8H,4-5,9,18H2,1H3