4-methoxy-N-(2-methoxyethyl)-2-[1-[(2-methylsulfanylpyrimidin-5-yl)methyl]piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: 4-methoxy-N-(2-methoxyethyl)-2-[1-[(2-methylsulfanylpyrimidin-5-yl)methyl]piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: 4-methoxy-N-(2-methoxyethyl)-2-[1-[(2-methylsulfanylpyrimidin-5-yl)methyl]piperidin-1-ium-4-yl]oxy-benzamide CAS Name: 4-methoxy-N-(2-methoxyethyl)-2-[[1-[[2-(methylthio)-5-pyrimidinyl]methyl]-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: 4-methoxy-N-(2-methoxyethyl)-2-[1-[(2-methylsulfanylpyrimidin-5-yl)methyl]piperidin-1-ium-4-yl]oxybenzamide Traditional Name: 4-methoxy-N-(2-methoxyethyl)-2-[1-[[2-(methylthio)pyrimidin-5-yl]methyl]piperidin-1-ium-4-yl]oxy-benzamide Formula: C22H31N4O4S+ MolecularWeight: 447.57094

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1=C(C=C(C=C1)OC)OC2CC[NH+](CC2)CC3=CN=C(N=C3)SC

Isomeric SMILES

COCCNC(=O)C1=C(C=C(C=C1)OC)OC2CC[NH+](CC2)CC3=CN=C(N=C3)SC

InChI

InChI=1S/C22H30N4O4S/c1-28-11-8-23-21(27)19-5-4-18(29-2)12-20(19)30-17-6-9-26(10-7-17)15-16-13-24-22(31-3)25-14-16/h4-5,12-14,17H,6-11,15H2,1-3H3,(H,23,27)/p+1