N-methyl-1-[5-(4-methylpiperazin-1-yl)-2-(4-methylsulfanylphenoxy)phenyl]methanamine

Systemtic Name: N-methyl-1-[5-(4-methylpiperazin-1-yl)-2-(4-methylsulfanylphenoxy)phenyl]methanamine Openeye Name: N-methyl-1-[5-(4-methylpiperazin-1-yl)-2-(4-methylsulfanylphenoxy)phenyl]methanamine CAS Name: N-methyl-1-[5-(4-methyl-1-piperazinyl)-2-[4-(methylthio)phenoxy]phenyl]methanamine IUPAC Name: N-methyl-1-[5-(4-methylpiperazin-1-yl)-2-(4-methylsulfanylphenoxy)phenyl]methanamine Traditional Name: methyl-[5-(4-methylpiperazino)-2-[4-(methylthio)phenoxy]benzyl]amine Formula: C20H27N3OS MolecularWeight: 357.51288

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=C(C=CC(=C1)N2CCN(CC2)C)OC3=CC=C(C=C3)SC

Isomeric SMILES

CNCC1=C(C=CC(=C1)N2CCN(CC2)C)OC3=CC=C(C=C3)SC

InChI

InChI=1S/C20H27N3OS/c1-21-15-16-14-17(23-12-10-22(2)11-13-23)4-9-20(16)24-18-5-7-19(25-3)8-6-18/h4-9,14,21H,10-13,15H2,1-3H3