2-azanyl-4-(5-bromanyl-2-methoxy-phenyl)-6-[4-(2-methylpropyl)phenyl]pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-(5-bromanyl-2-methoxy-phenyl)-6-[4-(2-methylpropyl)phenyl]pyridine-3-carbonitrile Openeye Name: 2-amino-4-(5-bromo-2-methoxy-phenyl)-6-(4-isobutylphenyl)pyridine-3-carbonitrile CAS Name: 2-amino-4-(5-bromo-2-methoxyphenyl)-6-[4-(2-methylpropyl)phenyl]-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(5-bromo-2-methoxyphenyl)-6-[4-(2-methylpropyl)phenyl]pyridine-3-carbonitrile Traditional Name: 2-amino-4-(5-bromo-2-methoxy-phenyl)-6-(4-isobutylphenyl)nicotinonitrile Formula: C23H22BrN3O MolecularWeight: 436.34428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22BrN3O/c1-14(2)10-15-4-6-16(7-5-15)21-12-18(20(13-25)23(26)27-21)19-11-17(24)8-9-22(19)28-3/h4-9,11-12,14H,10H2,1-3H3,(H2,26,27)