2-[[5,7-bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(2-methoxy-5-methyl-phenyl)-2-phenyl-ethanamide

Systemtic Name: 2-[[5,7-bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(2-methoxy-5-methyl-phenyl)-2-phenyl-ethanamide Openeye Name: 2-[[5,7-bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(2-methoxy-5-methyl-phenyl)-2-phenyl-acetamide CAS Name: 2-[[5,7-bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]thio]-N-(2-methoxy-5-methylphenyl)-2-phenylacetamide IUPAC Name: 2-[[5,7-bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(2-methoxy-5-methylphenyl)-2-phenylacetamide Traditional Name: 2-[[5,7-bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]thio]-N-(2-methoxy-5-methyl-phenyl)-2-phenyl-acetamide Formula: C24H28N8O2S MolecularWeight: 492.59652

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC2=NN=C(N2C(=N1)NCC)SC(C3=CC=CC=C3)C(=O)NC4=C(C=CC(=C4)C)OC

Isomeric SMILES

CCNC1=NC2=NN=C(N2C(=N1)NCC)SC(C3=CC=CC=C3)C(=O)NC4=C(C=CC(=C4)C)OC

InChI

InChI=1S/C24H28N8O2S/c1-5-25-21-28-22(26-6-2)32-23(29-21)30-31-24(32)35-19(16-10-8-7-9-11-16)20(33)27-17-14-15(3)12-13-18(17)34-4/h7-14,19H,5-6H2,1-4H3,(H,27,33)(H2,25,26,28,29,30)