2-azanyl-4-(5-bromanyl-2-methoxy-phenyl)-6-(2,5-dimethoxyphenyl)pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-(5-bromanyl-2-methoxy-phenyl)-6-(2,5-dimethoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-amino-4-(5-bromo-2-methoxy-phenyl)-6-(2,5-dimethoxyphenyl)pyridine-3-carbonitrile CAS Name: 2-amino-4-(5-bromo-2-methoxyphenyl)-6-(2,5-dimethoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(5-bromo-2-methoxyphenyl)-6-(2,5-dimethoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-amino-4-(5-bromo-2-methoxy-phenyl)-6-(2,5-dimethoxyphenyl)nicotinonitrile Formula: C21H18BrN3O3 MolecularWeight: 440.28992

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=NC(=C(C(=C2)C3=C(C=CC(=C3)Br)OC)C#N)N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=NC(=C(C(=C2)C3=C(C=CC(=C3)Br)OC)C#N)N

InChI

InChI=1S/C21H18BrN3O3/c1-26-13-5-7-20(28-3)16(9-13)18-10-14(17(11-23)21(24)25-18)15-8-12(22)4-6-19(15)27-2/h4-10H,1-3H3,(H2,24,25)