5,7-dimethyl-2-(naphthalen-1-ylmethylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine

Systemtic Name: 5,7-dimethyl-2-(naphthalen-1-ylmethylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine Openeye Name: 5,7-dimethyl-2-(1-naphthylmethylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine CAS Name: 5,7-dimethyl-2-(1-naphthalenylmethylthio)-[1,2,4]triazolo[1,5-a]pyrimidine IUPAC Name: 5,7-dimethyl-2-(naphthalen-1-ylmethylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine Traditional Name: 5,7-dimethyl-2-(1-naphthylmethylthio)-[1,2,4]triazolo[1,5-a]pyrimidine Formula: C18H16N4S MolecularWeight: 320.41144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=NC(=NN12)SCC3=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CC1=CC(=NC2=NC(=NN12)SCC3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C18H16N4S/c1-12-10-13(2)22-17(19-12)20-18(21-22)23-11-15-8-5-7-14-6-3-4-9-16(14)15/h3-10H,11H2,1-2H3