2-azanyl-4-(5-bromanyl-2-methoxy-phenyl)-5-(2-methoxyphenyl)-6-methyl-pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-(5-bromanyl-2-methoxy-phenyl)-5-(2-methoxyphenyl)-6-methyl-pyridine-3-carbonitrile Openeye Name: 2-amino-4-(5-bromo-2-methoxy-phenyl)-5-(2-methoxyphenyl)-6-methyl-pyridine-3-carbonitrile CAS Name: 2-amino-4-(5-bromo-2-methoxyphenyl)-5-(2-methoxyphenyl)-6-methyl-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(5-bromo-2-methoxyphenyl)-5-(2-methoxyphenyl)-6-methylpyridine-3-carbonitrile Traditional Name: 2-amino-4-(5-bromo-2-methoxy-phenyl)-5-(2-methoxyphenyl)-6-methyl-nicotinonitrile Formula: C21H18BrN3O2 MolecularWeight: 424.29052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)N)C#N)C2=C(C=CC(=C2)Br)OC)C3=CC=CC=C3OC

Isomeric SMILES

CC1=C(C(=C(C(=N1)N)C#N)C2=C(C=CC(=C2)Br)OC)C3=CC=CC=C3OC

InChI

InChI=1S/C21H18BrN3O2/c1-12-19(14-6-4-5-7-17(14)26-2)20(16(11-23)21(24)25-12)15-10-13(22)8-9-18(15)27-3/h4-10H,1-3H3,(H2,24,25)