2-(4-methyl-1,4-diazepan-1-yl)-2-(4-methylsulfanylphenyl)ethanamine

Systemtic Name: 2-(4-methyl-1,4-diazepan-1-yl)-2-(4-methylsulfanylphenyl)ethanamine Openeye Name: 2-(4-methyl-1,4-diazepan-1-yl)-2-(4-methylsulfanylphenyl)ethanamine CAS Name: 2-(4-methyl-1,4-diazepan-1-yl)-2-[4-(methylthio)phenyl]ethanamine IUPAC Name: 2-(4-methyl-1,4-diazepan-1-yl)-2-(4-methylsulfanylphenyl)ethanamine Traditional Name: [2-(4-methyl-1,4-diazepan-1-yl)-2-[4-(methylthio)phenyl]ethyl]amine Formula: C15H25N3S MolecularWeight: 279.4441

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C(CN)C2=CC=C(C=C2)SC

Isomeric SMILES

CN1CCCN(CC1)C(CN)C2=CC=C(C=C2)SC

InChI

InChI=1S/C15H25N3S/c1-17-8-3-9-18(11-10-17)15(12-16)13-4-6-14(19-2)7-5-13/h4-7,15H,3,8-12,16H2,1-2H3