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

Systemtic Name: 4-[5-[(3-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-[(3-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[(3-bromophenyl)methylthio]-4-ethyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[(3-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-[(3-bromobenzyl)thio]-4-ethyl-1,2,4-triazol-3-yl]pyridine Formula: C16H15BrN4S MolecularWeight: 375.2861

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15BrN4S/c1-2-21-15(13-6-8-18-9-7-13)19-20-16(21)22-11-12-4-3-5-14(17)10-12/h3-10H,2,11H2,1H3