2-[[5-(dimethylaminomethyl)-2-methoxy-phenyl]methylsulfanyl]ethanamine

Systemtic Name: 2-[[5-(dimethylaminomethyl)-2-methoxy-phenyl]methylsulfanyl]ethanamine Openeye Name: 2-[[5-(dimethylaminomethyl)-2-methoxy-phenyl]methylsulfanyl]ethanamine CAS Name: 2-[[5-(dimethylaminomethyl)-2-methoxyphenyl]methylthio]ethanamine IUPAC Name: 2-[[5-(dimethylaminomethyl)-2-methoxyphenyl]methylsulfanyl]ethanamine Traditional Name: [3-[(2-aminoethylthio)methyl]-4-methoxy-benzyl]-dimethyl-amine Formula: C13H22N2OS MolecularWeight: 254.39158

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC(=C(C=C1)OC)CSCCN

Isomeric SMILES

CN(C)CC1=CC(=C(C=C1)OC)CSCCN

InChI

InChI=1S/C13H22N2OS/c1-15(2)9-11-4-5-13(16-3)12(8-11)10-17-7-6-14/h4-5,8H,6-7,9-10,14H2,1-3H3