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

Systemtic Name: (5-hex-1-ynylpyridin-3-yl)-[2-[(5-methyl-2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxymethyl]morpholin-4-yl]methanone Openeye Name: (5-hex-1-ynyl-3-pyridyl)-[2-[(5-methyl-2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxymethyl]morpholin-4-yl]methanone CAS Name: (5-hex-1-ynyl-3-pyridinyl)-[2-[[5-methyl-2-(methylthio)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]oxymethyl]-4-morpholinyl]methanone IUPAC Name: (5-hex-1-ynylpyridin-3-yl)-[2-[(5-methyl-2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxymethyl]morpholin-4-yl]methanone Traditional Name: (5-hex-1-ynyl-3-pyridyl)-[2-[[5-methyl-2-(methylthio)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]oxymethyl]morpholino]methanone Formula: C24H28N6O3S MolecularWeight: 480.58252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=CC(=CN=C1)C(=O)N2CCOC(C2)COC3=CC(=NC4=NC(=NN34)SC)C

Isomeric SMILES

CCCCC#CC1=CC(=CN=C1)C(=O)N2CCOC(C2)COC3=CC(=NC4=NC(=NN34)SC)C

InChI

InChI=1S/C24H28N6O3S/c1-4-5-6-7-8-18-12-19(14-25-13-18)22(31)29-9-10-32-20(15-29)16-33-21-11-17(2)26-23-27-24(34-3)28-30(21)23/h11-14,20H,4-6,9-10,15-16H2,1-3H3