2-azanyl-4-(3-bromophenyl)-5-cyclohexyl-6-[6-(dimethylamino)pyridin-3-yl]pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-bromophenyl)-5-cyclohexyl-6-[6-(dimethylamino)pyridin-3-yl]pyridine-3-carbonitrile Openeye Name: 2-amino-4-(3-bromophenyl)-5-cyclohexyl-6-[6-(dimethylamino)-3-pyridyl]pyridine-3-carbonitrile CAS Name: 2-amino-4-(3-bromophenyl)-5-cyclohexyl-6-[6-(dimethylamino)-3-pyridinyl]-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(3-bromophenyl)-5-cyclohexyl-6-[6-(dimethylamino)pyridin-3-yl]pyridine-3-carbonitrile Traditional Name: 2-amino-4-(3-bromophenyl)-5-cyclohexyl-6-[6-(dimethylamino)-3-pyridyl]nicotinonitrile Formula: C25H26BrN5 MolecularWeight: 476.41144

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C(C=C1)C2=C(C(=C(C(=N2)N)C#N)C3=CC(=CC=C3)Br)C4CCCCC4

Isomeric SMILES

CN(C)C1=NC=C(C=C1)C2=C(C(=C(C(=N2)N)C#N)C3=CC(=CC=C3)Br)C4CCCCC4

InChI

InChI=1S/C25H26BrN5/c1-31(2)21-12-11-18(15-29-21)24-23(16-7-4-3-5-8-16)22(20(14-27)25(28)30-24)17-9-6-10-19(26)13-17/h6,9-13,15-16H,3-5,7-8H2,1-2H3,(H2,28,30)