2-[5-[(3-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]pyrazine

Systemtic Name: 2-[5-[(3-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]pyrazine Openeye Name: 2-[5-[(3-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]pyrazine CAS Name: 2-[5-[(3-bromophenyl)methylthio]-4-ethyl-1,2,4-triazol-3-yl]pyrazine IUPAC Name: 2-[5-[(3-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]pyrazine Traditional Name: 2-[5-[(3-bromobenzyl)thio]-4-ethyl-1,2,4-triazol-3-yl]pyrazine Formula: C15H14BrN5S MolecularWeight: 376.27416

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC(=CC=C2)Br)C3=NC=CN=C3

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC(=CC=C2)Br)C3=NC=CN=C3

InChI

InChI=1S/C15H14BrN5S/c1-2-21-14(13-9-17-6-7-18-13)19-20-15(21)22-10-11-4-3-5-12(16)8-11/h3-9H,2,10H2,1H3