N-[(1-methylpiperidin-3-yl)methyl]-N-[(2-methylsulfanylpyrimidin-5-yl)methyl]-2-phenyl-ethanamine

Systemtic Name: N-[(1-methylpiperidin-3-yl)methyl]-N-[(2-methylsulfanylpyrimidin-5-yl)methyl]-2-phenyl-ethanamine Openeye Name: N-[(1-methyl-3-piperidyl)methyl]-N-[(2-methylsulfanylpyrimidin-5-yl)methyl]-2-phenyl-ethanamine CAS Name: N-[(1-methyl-3-piperidinyl)methyl]-N-[[2-(methylthio)-5-pyrimidinyl]methyl]-2-phenylethanamine IUPAC Name: N-[(1-methylpiperidin-3-yl)methyl]-N-[(2-methylsulfanylpyrimidin-5-yl)methyl]-2-phenylethanamine Traditional Name: (1-methyl-3-piperidyl)methyl-[[2-(methylthio)pyrimidin-5-yl]methyl]-phenethyl-amine Formula: C21H30N4S MolecularWeight: 370.5547

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1)CN(CCC2=CC=CC=C2)CC3=CN=C(N=C3)SC

Isomeric SMILES

CN1CCCC(C1)CN(CCC2=CC=CC=C2)CC3=CN=C(N=C3)SC

InChI

InChI=1S/C21H30N4S/c1-24-11-6-9-19(15-24)16-25(12-10-18-7-4-3-5-8-18)17-20-13-22-21(26-2)23-14-20/h3-5,7-8,13-14,19H,6,9-12,15-17H2,1-2H3