N-[(3-chloranyl-4-methoxy-phenyl)methyl]pyrimidin-4-amine

Systemtic Name: N-[(3-chloranyl-4-methoxy-phenyl)methyl]pyrimidin-4-amine Openeye Name: N-[(3-chloro-4-methoxy-phenyl)methyl]pyrimidin-4-amine CAS Name: N-[(3-chloro-4-methoxyphenyl)methyl]-4-pyrimidinamine IUPAC Name: N-[(3-chloro-4-methoxyphenyl)methyl]pyrimidin-4-amine Traditional Name: (3-chloro-4-methoxy-benzyl)-(4-pyrimidyl)amine Formula: C12H12ClN3O MolecularWeight: 249.69618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=NC=NC=C2)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=NC=NC=C2)Cl

InChI

InChI=1S/C12H12ClN3O/c1-17-11-3-2-9(6-10(11)13)7-15-12-4-5-14-8-16-12/h2-6,8H,7H2,1H3,(H,14,15,16)