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

Systemtic Name: 2-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-5-methyl-aniline Openeye Name: 2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-5-methyl-aniline CAS Name: 2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-5-methylaniline IUPAC Name: 2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-5-methylaniline Traditional Name: [2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-5-methyl-phenyl]amine Formula: C16H16ClNO2S MolecularWeight: 321.82174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC2=CC3=C(C(=C2)Cl)OCCO3)N

Isomeric SMILES

CC1=CC(=C(C=C1)SCC2=CC3=C(C(=C2)Cl)OCCO3)N

InChI

InChI=1S/C16H16ClNO2S/c1-10-2-3-15(13(18)6-10)21-9-11-7-12(17)16-14(8-11)19-4-5-20-16/h2-3,6-8H,4-5,9,18H2,1H3