2-azanyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-6-(pyridin-3-ylmethylamino)pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-6-(pyridin-3-ylmethylamino)pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-(4-tert-butoxyphenyl)-6-(3-pyridylmethylamino)pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-6-(3-pyridinylmethylamino)pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-6-(pyridin-3-ylmethylamino)pyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-(4-tert-butoxyphenyl)-6-(3-pyridylmethylamino)dinicotinonitrile Formula: C23H22N6O MolecularWeight: 398.46038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1=CC=C(C=C1)C2=C(C(=NC(=C2C#N)NCC3=CN=CC=C3)N)C#N

Isomeric SMILES

CC(C)(C)OC1=CC=C(C=C1)C2=C(C(=NC(=C2C#N)NCC3=CN=CC=C3)N)C#N

InChI

InChI=1S/C23H22N6O/c1-23(2,3)30-17-8-6-16(7-9-17)20-18(11-24)21(26)29-22(19(20)12-25)28-14-15-5-4-10-27-13-15/h4-10,13H,14H2,1-3H3,(H3,26,28,29)