2-[5-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyrazine

Systemtic Name: 2-[5-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyrazine Openeye Name: 2-[5-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyrazine CAS Name: 2-[5-[(2-chloro-6-fluorophenyl)methylthio]-4-methyl-1,2,4-triazol-3-yl]pyrazine IUPAC Name: 2-[5-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyrazine Traditional Name: 2-[5-[(2-chloro-6-fluoro-benzyl)thio]-4-methyl-1,2,4-triazol-3-yl]pyrazine Formula: C14H11ClFN5S MolecularWeight: 335.787043

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=C(C=CC=C2Cl)F)C3=NC=CN=C3

Isomeric SMILES

CN1C(=NN=C1SCC2=C(C=CC=C2Cl)F)C3=NC=CN=C3

InChI

InChI=1S/C14H11ClFN5S/c1-21-13(12-7-17-5-6-18-12)19-20-14(21)22-8-9-10(15)3-2-4-11(9)16/h2-7H,8H2,1H3