4-[(3-chloranyl-4-methyl-phenyl)amino]-2-methyl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-[(3-chloranyl-4-methyl-phenyl)amino]-2-methyl-pyrimidine-5-carboxylic acid Openeye Name: 4-(3-chloro-4-methyl-anilino)-2-methyl-pyrimidine-5-carboxylic acid CAS Name: 4-(3-chloro-4-methylanilino)-2-methyl-5-pyrimidinecarboxylic acid IUPAC Name: 4-(3-chloro-4-methylanilino)-2-methylpyrimidine-5-carboxylic acid Traditional Name: 4-(3-chloro-4-methyl-anilino)-2-methyl-pyrimidine-5-carboxylic acid Formula: C13H12ClN3O2 MolecularWeight: 277.70628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC(=NC=C2C(=O)O)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC(=NC=C2C(=O)O)C)Cl

InChI

InChI=1S/C13H12ClN3O2/c1-7-3-4-9(5-11(7)14)17-12-10(13(18)19)6-15-8(2)16-12/h3-6H,1-2H3,(H,18,19)(H,15,16,17)