2-azanyl-4-(5-bromanyl-2-methoxy-phenyl)-6-pyridin-3-yl-pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-(5-bromanyl-2-methoxy-phenyl)-6-pyridin-3-yl-pyridine-3-carbonitrile Openeye Name: 2-amino-4-(5-bromo-2-methoxy-phenyl)-6-(3-pyridyl)pyridine-3-carbonitrile CAS Name: 2-amino-4-(5-bromo-2-methoxyphenyl)-6-(3-pyridinyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(5-bromo-2-methoxyphenyl)-6-pyridin-3-ylpyridine-3-carbonitrile Traditional Name: 2-amino-4-(5-bromo-2-methoxy-phenyl)-6-(3-pyridyl)nicotinonitrile Formula: C18H13BrN4O MolecularWeight: 381.22602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C2=CC(=NC(=C2C#N)N)C3=CN=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C2=CC(=NC(=C2C#N)N)C3=CN=CC=C3

InChI

InChI=1S/C18H13BrN4O/c1-24-17-5-4-12(19)7-14(17)13-8-16(11-3-2-6-22-10-11)23-18(21)15(13)9-20/h2-8,10H,1H3,(H2,21,23)