6-tert-butyl-8-(2-pyridin-4-ylethylamino)-2H-[1,2,4]triazolo[4,3-a]pyrazin-3-one

Systemtic Name: 6-tert-butyl-8-(2-pyridin-4-ylethylamino)-2H-[1,2,4]triazolo[4,3-a]pyrazin-3-one Openeye Name: 6-tert-butyl-8-[2-(4-pyridyl)ethylamino]-2H-[1,2,4]triazolo[4,3-a]pyrazin-3-one CAS Name: 6-tert-butyl-8-(2-pyridin-4-ylethylamino)-2H-[1,2,4]triazolo[4,3-a]pyrazin-3-one IUPAC Name: 6-tert-butyl-8-(2-pyridin-4-ylethylamino)-2H-[1,2,4]triazolo[4,3-a]pyrazin-3-one Traditional Name: 6-tert-butyl-8-[2-(4-pyridyl)ethylamino]-2H-[1,2,4]triazolo[4,3-a]pyrazin-3-one Formula: C16H20N6O MolecularWeight: 312.3696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CN2C(=NNC2=O)C(=N1)NCCC3=CC=NC=C3

Isomeric SMILES

CC(C)(C)C1=CN2C(=NNC2=O)C(=N1)NCCC3=CC=NC=C3

InChI

InChI=1S/C16H20N6O/c1-16(2,3)12-10-22-14(20-21-15(22)23)13(19-12)18-9-6-11-4-7-17-8-5-11/h4-5,7-8,10H,6,9H2,1-3H3,(H,18,19)(H,21,23)