2-azanyl-4-(3-bromophenyl)-6-(6-morpholin-4-ylpyridin-3-yl)-5-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-bromophenyl)-6-(6-morpholin-4-ylpyridin-3-yl)-5-phenyl-pyridine-3-carbonitrile Openeye Name: 2-amino-4-(3-bromophenyl)-6-(6-morpholino-3-pyridyl)-5-phenyl-pyridine-3-carbonitrile CAS Name: 2-amino-4-(3-bromophenyl)-6-[6-(4-morpholinyl)-3-pyridinyl]-5-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(3-bromophenyl)-6-(6-morpholin-4-ylpyridin-3-yl)-5-phenylpyridine-3-carbonitrile Traditional Name: 2-amino-4-(3-bromophenyl)-6-(6-morpholino-3-pyridyl)-5-phenyl-nicotinonitrile Formula: C27H22BrN5O MolecularWeight: 512.40048

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=C(C=C2)C3=C(C(=C(C(=N3)N)C#N)C4=CC(=CC=C4)Br)C5=CC=CC=C5

Isomeric SMILES

C1COCCN1C2=NC=C(C=C2)C3=C(C(=C(C(=N3)N)C#N)C4=CC(=CC=C4)Br)C5=CC=CC=C5

InChI

InChI=1S/C27H22BrN5O/c28-21-8-4-7-19(15-21)24-22(16-29)27(30)32-26(25(24)18-5-2-1-3-6-18)20-9-10-23(31-17-20)33-11-13-34-14-12-33/h1-10,15,17H,11-14H2,(H2,30,32)