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

Systemtic Name: 2-azanyl-4-(3-bromophenyl)-5-(4-fluorophenyl)-6-(6-morpholin-4-ylpyridin-3-yl)pyridine-3-carbonitrile Openeye Name: 2-amino-4-(3-bromophenyl)-5-(4-fluorophenyl)-6-(6-morpholino-3-pyridyl)pyridine-3-carbonitrile CAS Name: 2-amino-4-(3-bromophenyl)-5-(4-fluorophenyl)-6-[6-(4-morpholinyl)-3-pyridinyl]-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(3-bromophenyl)-5-(4-fluorophenyl)-6-(6-morpholin-4-ylpyridin-3-yl)pyridine-3-carbonitrile Traditional Name: 2-amino-4-(3-bromophenyl)-5-(4-fluorophenyl)-6-(6-morpholino-3-pyridyl)nicotinonitrile Formula: C27H21BrFN5O MolecularWeight: 530.390943

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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=C(C=C5)F

Isomeric SMILES

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

InChI

InChI=1S/C27H21BrFN5O/c28-20-3-1-2-18(14-20)24-22(15-30)27(31)33-26(25(24)17-4-7-21(29)8-5-17)19-6-9-23(32-16-19)34-10-12-35-13-11-34/h1-9,14,16H,10-13H2,(H2,31,33)