2-bromanyl-N4-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-6-methyl-pyrimidine-4,5-diamine

Systemtic Name: 2-bromanyl-N4-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-6-methyl-pyrimidine-4,5-diamine Openeye Name: 2-bromo-N4-[[3-(cyclopentoxy)-4-methoxy-phenyl]methyl]-6-methyl-pyrimidine-4,5-diamine CAS Name: 2-bromo-N4-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-6-methylpyrimidine-4,5-diamine IUPAC Name: 2-bromo-4-N-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-6-methylpyrimidine-4,5-diamine Traditional Name: (5-amino-2-bromo-6-methyl-pyrimidin-4-yl)-[3-(cyclopentoxy)-4-methoxy-benzyl]amine Formula: C18H23BrN4O2 MolecularWeight: 407.30482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)Br)NCC2=CC(=C(C=C2)OC)OC3CCCC3)N

Isomeric SMILES

CC1=C(C(=NC(=N1)Br)NCC2=CC(=C(C=C2)OC)OC3CCCC3)N

InChI

InChI=1S/C18H23BrN4O2/c1-11-16(20)17(23-18(19)22-11)21-10-12-7-8-14(24-2)15(9-12)25-13-5-3-4-6-13/h7-9,13H,3-6,10,20H2,1-2H3,(H,21,22,23)