2,3-bis(oxidanyl)butanedioic acid; N-methyl-1-[3-(3-methyl-4-methylsulfanyl-phenoxy)pyridin-4-yl]methanamine

Systemtic Name: 2,3-bis(oxidanyl)butanedioic acid; N-methyl-1-[3-(3-methyl-4-methylsulfanyl-phenoxy)pyridin-4-yl]methanamine Openeye Name: 2,3-dihydroxybutanedioic acid; N-methyl-1-[3-(3-methyl-4-methylsulfanyl-phenoxy)-4-pyridyl]methanamine CAS Name: 2,3-dihydroxybutanedioic acid; N-methyl-1-[3-[3-methyl-4-(methylthio)phenoxy]-4-pyridinyl]methanamine IUPAC Name: 2,3-dihydroxybutanedioic acid; N-methyl-1-[3-(3-methyl-4-methylsulfanylphenoxy)pyridin-4-yl]methanamine Traditional Name: methyl-[[3-[3-methyl-4-(methylthio)phenoxy]-4-pyridyl]methyl]amine; tartaric acid Formula: C19H24N2O7S MolecularWeight: 424.46806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(C=CN=C2)CNC)SC.C(C(C(=O)O)O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(C=CN=C2)CNC)SC.C(C(C(=O)O)O)(C(=O)O)O

InChI

InChI=1S/C15H18N2OS.C4H6O6/c1-11-8-13(4-5-15(11)19-3)18-14-10-17-7-6-12(14)9-16-2;5-1(3(7)8)2(6)4(9)10/h4-8,10,16H,9H2,1-3H3;1-2,5-6H,(H,7,8)(H,9,10)