2-azanyl-3-pyrimidin-2-yl-4-(2,4,6-trimethylphenoxy)benzenecarbonitrile

Systemtic Name: 2-azanyl-3-pyrimidin-2-yl-4-(2,4,6-trimethylphenoxy)benzenecarbonitrile Openeye Name: 2-amino-3-pyrimidin-2-yl-4-(2,4,6-trimethylphenoxy)benzonitrile CAS Name: 2-amino-3-(2-pyrimidinyl)-4-(2,4,6-trimethylphenoxy)benzonitrile IUPAC Name: 2-amino-3-pyrimidin-2-yl-4-(2,4,6-trimethylphenoxy)benzonitrile Traditional Name: 2-amino-3-(2-pyrimidyl)-4-(2,4,6-trimethylphenoxy)benzonitrile Formula: C20H18N4O MolecularWeight: 330.38312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OC2=C(C(=C(C=C2)C#N)N)C3=NC=CC=N3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OC2=C(C(=C(C=C2)C#N)N)C3=NC=CC=N3)C

InChI

InChI=1S/C20H18N4O/c1-12-9-13(2)19(14(3)10-12)25-16-6-5-15(11-21)18(22)17(16)20-23-7-4-8-24-20/h4-10H,22H2,1-3H3