5-methyl-2-methylsulfanyl-6-(naphthalen-1-ylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 5-methyl-2-methylsulfanyl-6-(naphthalen-1-ylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Openeye Name: 5-methyl-2-methylsulfanyl-6-(1-naphthylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one CAS Name: 5-methyl-2-(methylthio)-6-(1-naphthalenylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one IUPAC Name: 5-methyl-2-methylsulfanyl-6-(naphthalen-1-ylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Traditional Name: 5-methyl-2-(methylthio)-6-(1-naphthylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Formula: C18H16N4OS MolecularWeight: 336.41084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N2C(=N1)N=C(N2)SC)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=C(C(=O)N2C(=N1)N=C(N2)SC)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C18H16N4OS/c1-11-15(16(23)22-17(19-11)20-18(21-22)24-2)10-13-8-5-7-12-6-3-4-9-14(12)13/h3-9H,10H2,1-2H3,(H,19,20,21)