2-[5-[(2-chloranylphenoxy)methyl]-6-methyl-pyrimidin-4-yl]-5-phenyl-pyrazol-3-amine

Systemtic Name: 2-[5-[(2-chloranylphenoxy)methyl]-6-methyl-pyrimidin-4-yl]-5-phenyl-pyrazol-3-amine Openeye Name: 2-[5-[(2-chlorophenoxy)methyl]-6-methyl-pyrimidin-4-yl]-5-phenyl-pyrazol-3-amine CAS Name: 2-[5-[(2-chlorophenoxy)methyl]-6-methyl-4-pyrimidinyl]-5-phenyl-3-pyrazolamine IUPAC Name: 2-[5-[(2-chlorophenoxy)methyl]-6-methylpyrimidin-4-yl]-5-phenylpyrazol-3-amine Traditional Name: [2-[5-[(2-chlorophenoxy)methyl]-6-methyl-pyrimidin-4-yl]-5-phenyl-pyrazol-3-yl]amine Formula: C21H18ClN5O MolecularWeight: 391.85352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=N1)N2C(=CC(=N2)C3=CC=CC=C3)N)COC4=CC=CC=C4Cl

Isomeric SMILES

CC1=C(C(=NC=N1)N2C(=CC(=N2)C3=CC=CC=C3)N)COC4=CC=CC=C4Cl

InChI

InChI=1S/C21H18ClN5O/c1-14-16(12-28-19-10-6-5-9-17(19)22)21(25-13-24-14)27-20(23)11-18(26-27)15-7-3-2-4-8-15/h2-11,13H,12,23H2,1H3