3-methyl-4-(oxan-2-ylmethylsulfanyl)aniline

Systemtic Name: 3-methyl-4-(oxan-2-ylmethylsulfanyl)aniline Openeye Name: 3-methyl-4-(tetrahydropyran-2-ylmethylsulfanyl)aniline CAS Name: 3-methyl-4-(2-oxanylmethylthio)aniline IUPAC Name: 3-methyl-4-(oxan-2-ylmethylsulfanyl)aniline Traditional Name: [3-methyl-4-(tetrahydropyran-2-ylmethylthio)phenyl]amine Formula: C13H19NOS MolecularWeight: 237.36106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N)SCC2CCCCO2

Isomeric SMILES

CC1=C(C=CC(=C1)N)SCC2CCCCO2

InChI

InChI=1S/C13H19NOS/c1-10-8-11(14)5-6-13(10)16-9-12-4-2-3-7-15-12/h5-6,8,12H,2-4,7,9,14H2,1H3