[2-[(5-methyl-2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxymethyl]morpholin-4-yl]-(2-pyridin-4-yl-1,3-thiazol-4-yl)methanone

Systemtic Name: [2-[(5-methyl-2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxymethyl]morpholin-4-yl]-(2-pyridin-4-yl-1,3-thiazol-4-yl)methanone Openeye Name: [2-[(5-methyl-2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxymethyl]morpholin-4-yl]-[2-(4-pyridyl)thiazol-4-yl]methanone CAS Name: [2-[[5-methyl-2-(methylthio)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]oxymethyl]-4-morpholinyl]-(2-pyridin-4-yl-4-thiazolyl)methanone IUPAC Name: [2-[(5-methyl-2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxymethyl]morpholin-4-yl]-(2-pyridin-4-yl-1,3-thiazol-4-yl)methanone Traditional Name: [2-[[5-methyl-2-(methylthio)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]oxymethyl]morpholino]-[2-(4-pyridyl)thiazol-4-yl]methanone Formula: C21H21N7O3S2 MolecularWeight: 483.56654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=NC(=NN2C(=C1)OCC3CN(CCO3)C(=O)C4=CSC(=N4)C5=CC=NC=C5)SC

Isomeric SMILES

CC1=NC2=NC(=NN2C(=C1)OCC3CN(CCO3)C(=O)C4=CSC(=N4)C5=CC=NC=C5)SC

InChI

InChI=1S/C21H21N7O3S2/c1-13-9-17(28-20(23-13)25-21(26-28)32-2)31-11-15-10-27(7-8-30-15)19(29)16-12-33-18(24-16)14-3-5-22-6-4-14/h3-6,9,12,15H,7-8,10-11H2,1-2H3