4-tert-butyl-N-[1-(3-isoquinolin-1-yl-5-oxidanylidene-2H-1,2,4-triazin-6-yl)propyl]cyclohexane-1-carboxamide

Systemtic Name: 4-tert-butyl-N-[1-(3-isoquinolin-1-yl-5-oxidanylidene-2H-1,2,4-triazin-6-yl)propyl]cyclohexane-1-carboxamide Openeye Name: 4-tert-butyl-N-[1-[3-(1-isoquinolyl)-5-oxo-2H-1,2,4-triazin-6-yl]propyl]cyclohexanecarboxamide CAS Name: 4-tert-butyl-N-[1-[3-(1-isoquinolinyl)-5-oxo-2H-1,2,4-triazin-6-yl]propyl]-1-cyclohexanecarboxamide IUPAC Name: 4-tert-butyl-N-[1-(3-isoquinolin-1-yl-5-oxo-2H-1,2,4-triazin-6-yl)propyl]cyclohexane-1-carboxamide Traditional Name: 4-tert-butyl-N-[1-[3-(1-isoquinolyl)-5-keto-2H-1,2,4-triazin-6-yl]propyl]cyclohexanecarboxamide Formula: C26H33N5O2 MolecularWeight: 447.57252

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NNC(=NC1=O)C2=NC=CC3=CC=CC=C32)NC(=O)C4CCC(CC4)C(C)(C)C

Isomeric SMILES

CCC(C1=NNC(=NC1=O)C2=NC=CC3=CC=CC=C32)NC(=O)C4CCC(CC4)C(C)(C)C

InChI

InChI=1S/C26H33N5O2/c1-5-20(28-24(32)17-10-12-18(13-11-17)26(2,3)4)22-25(33)29-23(31-30-22)21-19-9-7-6-8-16(19)14-15-27-21/h6-9,14-15,17-18,20H,5,10-13H2,1-4H3,(H,28,32)(H,29,31,33)