methyl 2-[(2-bromanyl-4-propyl-phenyl)amino]-6-methyl-pyrimidine-4-carboxylate

Systemtic Name: methyl 2-[(2-bromanyl-4-propyl-phenyl)amino]-6-methyl-pyrimidine-4-carboxylate Openeye Name: methyl 2-(2-bromo-4-propyl-anilino)-6-methyl-pyrimidine-4-carboxylate CAS Name: 2-(2-bromo-4-propylanilino)-6-methyl-4-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2-(2-bromo-4-propylanilino)-6-methylpyrimidine-4-carboxylate Traditional Name: 2-(2-bromo-4-propyl-anilino)-6-methyl-pyrimidine-4-carboxylic acid methyl ester Formula: C16H18BrN3O2 MolecularWeight: 364.23702

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)NC2=NC(=CC(=N2)C)C(=O)OC)Br

Isomeric SMILES

CCCC1=CC(=C(C=C1)NC2=NC(=CC(=N2)C)C(=O)OC)Br

InChI

InChI=1S/C16H18BrN3O2/c1-4-5-11-6-7-13(12(17)9-11)19-16-18-10(2)8-14(20-16)15(21)22-3/h6-9H,4-5H2,1-3H3,(H,18,19,20)