methyl 2-[1-(2-bromanyl-4-propan-2-yl-phenyl)ethylamino]-6-methyl-pyrimidine-4-carboxylate

Systemtic Name: methyl 2-[1-(2-bromanyl-4-propan-2-yl-phenyl)ethylamino]-6-methyl-pyrimidine-4-carboxylate Openeye Name: methyl 2-[1-(2-bromo-4-isopropyl-phenyl)ethylamino]-6-methyl-pyrimidine-4-carboxylate CAS Name: 2-[1-(2-bromo-4-propan-2-ylphenyl)ethylamino]-6-methyl-4-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2-[1-(2-bromo-4-propan-2-ylphenyl)ethylamino]-6-methylpyrimidine-4-carboxylate Traditional Name: 2-[1-(2-bromo-4-isopropyl-phenyl)ethylamino]-6-methyl-pyrimidine-4-carboxylic acid methyl ester Formula: C18H22BrN3O2 MolecularWeight: 392.29018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C(=O)OC)NC(C)C2=C(C=C(C=C2)C(C)C)Br

Isomeric SMILES

CC1=NC(=NC(=C1)C(=O)OC)NC(C)C2=C(C=C(C=C2)C(C)C)Br

InChI

InChI=1S/C18H22BrN3O2/c1-10(2)13-6-7-14(15(19)9-13)12(4)21-18-20-11(3)8-16(22-18)17(23)24-5/h6-10,12H,1-5H3,(H,20,21,22)