N-[(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methyl]-5-chloranyl-2,6-dimethyl-pyrimidin-4-amine

Systemtic Name: N-[(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methyl]-5-chloranyl-2,6-dimethyl-pyrimidin-4-amine Openeye Name: N-[(4-benzyloxy-3-bromo-5-methoxy-phenyl)methyl]-5-chloro-2,6-dimethyl-pyrimidin-4-amine CAS Name: N-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methyl]-5-chloro-2,6-dimethyl-4-pyrimidinamine IUPAC Name: N-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methyl]-5-chloro-2,6-dimethylpyrimidin-4-amine Traditional Name: (4-benzoxy-3-bromo-5-methoxy-benzyl)-(5-chloro-2,6-dimethyl-pyrimidin-4-yl)amine Formula: C21H21BrClN3O2 MolecularWeight: 462.76734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)NCC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)OC)Cl

Isomeric SMILES

CC1=C(C(=NC(=N1)C)NCC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)OC)Cl

InChI

InChI=1S/C21H21BrClN3O2/c1-13-19(23)21(26-14(2)25-13)24-11-16-9-17(22)20(18(10-16)27-3)28-12-15-7-5-4-6-8-15/h4-10H,11-12H2,1-3H3,(H,24,25,26)