2,3-bis(oxidanyl)butanedioic acid; 5-(4-chlorophenyl)-6-ethyl-pyrimidine-2,4-diamine

Systemtic Name: 2,3-bis(oxidanyl)butanedioic acid; 5-(4-chlorophenyl)-6-ethyl-pyrimidine-2,4-diamine Openeye Name: 5-(4-chlorophenyl)-6-ethyl-pyrimidine-2,4-diamine; 2,3-dihydroxybutanedioic acid CAS Name: 5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine; 2,3-dihydroxybutanedioic acid IUPAC Name: 5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine; 2,3-dihydroxybutanedioic acid Traditional Name: [2-amino-5-(4-chlorophenyl)-6-ethyl-pyrimidin-4-yl]amine; tartaric acid Formula: C16H19ClN4O6 MolecularWeight: 398.79826

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)Cl.C(C(C(=O)O)O)(C(=O)O)O

Isomeric SMILES

CCC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)Cl.C(C(C(=O)O)O)(C(=O)O)O

InChI

InChI=1S/C12H13ClN4.C4H6O6/c1-2-9-10(11(14)17-12(15)16-9)7-3-5-8(13)6-4-7;5-1(3(7)8)2(6)4(9)10/h3-6H,2H2,1H3,(H4,14,15,16,17);1-2,5-6H,(H,7,8)(H,9,10)