5-chloranyl-6-phenyl-7-(1,4,5,6-tetrahydropyrimidin-2-ylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine

Systemtic Name: 5-chloranyl-6-phenyl-7-(1,4,5,6-tetrahydropyrimidin-2-ylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine Openeye Name: 5-chloro-6-phenyl-7-(1,4,5,6-tetrahydropyrimidin-2-ylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine CAS Name: 5-chloro-6-phenyl-7-(1,4,5,6-tetrahydropyrimidin-2-ylthio)-[1,2,4]triazolo[1,5-a]pyrimidine IUPAC Name: 5-chloro-6-phenyl-7-(1,4,5,6-tetrahydropyrimidin-2-ylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine Traditional Name: 5-chloro-6-phenyl-7-(1,4,5,6-tetrahydropyrimidin-2-ylthio)-[1,2,4]triazolo[1,5-a]pyrimidine Formula: C15H13ClN6S MolecularWeight: 344.82192

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=NC1)SC2=C(C(=NC3=NC=NN23)Cl)C4=CC=CC=C4

Isomeric SMILES

C1CNC(=NC1)SC2=C(C(=NC3=NC=NN23)Cl)C4=CC=CC=C4

InChI

InChI=1S/C15H13ClN6S/c16-12-11(10-5-2-1-3-6-10)13(22-14(21-12)19-9-20-22)23-15-17-7-4-8-18-15/h1-3,5-6,9H,4,7-8H2,(H,17,18)