2-azanyl-4-[[2,6-bis(chloranyl)phenyl]methyl]-3-pyrimidin-2-yl-benzenecarbonitrile

Systemtic Name: 2-azanyl-4-[[2,6-bis(chloranyl)phenyl]methyl]-3-pyrimidin-2-yl-benzenecarbonitrile Openeye Name: 2-amino-4-[(2,6-dichlorophenyl)methyl]-3-pyrimidin-2-yl-benzonitrile CAS Name: 2-amino-4-[(2,6-dichlorophenyl)methyl]-3-(2-pyrimidinyl)benzonitrile IUPAC Name: 2-amino-4-[(2,6-dichlorophenyl)methyl]-3-pyrimidin-2-ylbenzonitrile Traditional Name: 2-amino-4-(2,6-dichlorobenzyl)-3-(2-pyrimidyl)benzonitrile Formula: C18H12Cl2N4 MolecularWeight: 355.22068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CC2=C(C(=C(C=C2)C#N)N)C3=NC=CC=N3)Cl

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CC2=C(C(=C(C=C2)C#N)N)C3=NC=CC=N3)Cl

InChI

InChI=1S/C18H12Cl2N4/c19-14-3-1-4-15(20)13(14)9-11-5-6-12(10-21)17(22)16(11)18-23-7-2-8-24-18/h1-8H,9,22H2