2-methyl-1-[2-[(5-methyl-2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxymethyl]morpholin-4-yl]pent-2-en-1-one

Systemtic Name: 2-methyl-1-[2-[(5-methyl-2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxymethyl]morpholin-4-yl]pent-2-en-1-one Openeye Name: 2-methyl-1-[2-[(5-methyl-2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxymethyl]morpholin-4-yl]pent-2-en-1-one CAS Name: 2-methyl-1-[2-[[5-methyl-2-(methylthio)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]oxymethyl]-4-morpholinyl]-2-penten-1-one IUPAC Name: 2-methyl-1-[2-[(5-methyl-2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxymethyl]morpholin-4-yl]pent-2-en-1-one Traditional Name: 2-methyl-1-[2-[[5-methyl-2-(methylthio)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]oxymethyl]morpholino]pent-2-en-1-one Formula: C18H25N5O3S MolecularWeight: 391.4878

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C(C)C(=O)N1CCOC(C1)COC2=CC(=NC3=NC(=NN23)SC)C

Isomeric SMILES

CCC=C(C)C(=O)N1CCOC(C1)COC2=CC(=NC3=NC(=NN23)SC)C

InChI

InChI=1S/C18H25N5O3S/c1-5-6-12(2)16(24)22-7-8-25-14(10-22)11-26-15-9-13(3)19-17-20-18(27-4)21-23(15)17/h6,9,14H,5,7-8,10-11H2,1-4H3