6-ethyl-5-methyl-2-(phenylmethylsulfanyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 6-ethyl-5-methyl-2-(phenylmethylsulfanyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Openeye Name: 2-benzylsulfanyl-6-ethyl-5-methyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one CAS Name: 6-ethyl-5-methyl-2-(phenylmethylthio)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one IUPAC Name: 2-benzylsulfanyl-6-ethyl-5-methyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Traditional Name: 2-(benzylthio)-6-ethyl-5-methyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Formula: C15H16N4OS MolecularWeight: 300.37874

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2N=C(NN2C1=O)SCC3=CC=CC=C3)C

Isomeric SMILES

CCC1=C(N=C2N=C(NN2C1=O)SCC3=CC=CC=C3)C

InChI

InChI=1S/C15H16N4OS/c1-3-12-10(2)16-14-17-15(18-19(14)13(12)20)21-9-11-7-5-4-6-8-11/h4-8H,3,9H2,1-2H3,(H,16,17,18)