2-[2-(aminomethyl)phenyl]sulfanyl-5-methyl-aniline; 2,3-bis(oxidanyl)butanedioic acid

Systemtic Name: 2-[2-(aminomethyl)phenyl]sulfanyl-5-methyl-aniline; 2,3-bis(oxidanyl)butanedioic acid Openeye Name: 2-[2-(aminomethyl)phenyl]sulfanyl-5-methyl-aniline; 2,3-dihydroxybutanedioic acid CAS Name: 2-[[2-(aminomethyl)phenyl]thio]-5-methylaniline; 2,3-dihydroxybutanedioic acid IUPAC Name: 2-[2-(aminomethyl)phenyl]sulfanyl-5-methylaniline; 2,3-dihydroxybutanedioic acid Traditional Name: [2-[(2-amino-4-methyl-phenyl)thio]benzyl]amine; tartaric acid Formula: C18H22N2O6S MolecularWeight: 394.44208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC2=CC=CC=C2CN)N.C(C(C(=O)O)O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)SC2=CC=CC=C2CN)N.C(C(C(=O)O)O)(C(=O)O)O

InChI

InChI=1S/C14H16N2S.C4H6O6/c1-10-6-7-14(12(16)8-10)17-13-5-3-2-4-11(13)9-15;5-1(3(7)8)2(6)4(9)10/h2-8H,9,15-16H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)