3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]propanamide

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]propanamide CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]propionamide Formula: C19H33N4OS+ MolecularWeight: 365.55652

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)CCC2=C(N=C(N=C2C)SC)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC(=O)CCC2=C(N=C(N=C2C)SC)C

InChI

InChI=1S/C19H32N4OS/c1-14-8-5-6-12-23(14)13-7-11-20-18(24)10-9-17-15(2)21-19(25-4)22-16(17)3/h14H,5-13H2,1-4H3,(H,20,24)/p+1/t14-/m0/s1