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

Systemtic Name: 2-azanyl-4-(3-bromanyl-4-methoxy-phenyl)-5-methyl-6-(4-methylphenyl)pyridine-3-carbonitrile Openeye Name: 2-amino-4-(3-bromo-4-methoxy-phenyl)-5-methyl-6-(p-tolyl)pyridine-3-carbonitrile CAS Name: 2-amino-4-(3-bromo-4-methoxyphenyl)-5-methyl-6-(4-methylphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(3-bromo-4-methoxyphenyl)-5-methyl-6-(4-methylphenyl)pyridine-3-carbonitrile Traditional Name: 2-amino-4-(3-bromo-4-methoxy-phenyl)-5-methyl-6-(p-tolyl)nicotinonitrile Formula: C21H18BrN3O MolecularWeight: 408.29112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=C(C(=N2)N)C#N)C3=CC(=C(C=C3)OC)Br)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=C(C(=N2)N)C#N)C3=CC(=C(C=C3)OC)Br)C

InChI

InChI=1S/C21H18BrN3O/c1-12-4-6-14(7-5-12)20-13(2)19(16(11-23)21(24)25-20)15-8-9-18(26-3)17(22)10-15/h4-10H,1-3H3,(H2,24,25)