2-ethylsulfanyl-5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate

Systemtic Name: 2-ethylsulfanyl-5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate Openeye Name: 2-ethylsulfanyl-5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate CAS Name: 2-(ethylthio)-5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate IUPAC Name: 2-ethylsulfanyl-5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate Traditional Name: 2-(ethylthio)-5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate Formula: C14H13N4O2S- MolecularWeight: 301.34362

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN2C(=CC(=NC2=N1)C3=CC=C(C=C3)OC)[O-]

Isomeric SMILES

CCSC1=NN2C(=CC(=NC2=N1)C3=CC=C(C=C3)OC)[O-]

InChI

InChI=1S/C14H14N4O2S/c1-3-21-14-16-13-15-11(8-12(19)18(13)17-14)9-4-6-10(20-2)7-5-9/h4-8,19H,3H2,1-2H3/p-1