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

Systemtic Name: 4-[5-[(4-bromophenyl)methylsulfanyl]-4-(4-ethylphenyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-[(4-bromophenyl)methylsulfanyl]-4-(4-ethylphenyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[(4-bromophenyl)methylthio]-4-(4-ethylphenyl)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[(4-bromophenyl)methylsulfanyl]-4-(4-ethylphenyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-[(4-bromobenzyl)thio]-4-(4-ethylphenyl)-1,2,4-triazol-3-yl]pyridine Formula: C22H19BrN4S MolecularWeight: 451.38206

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)Br)C4=CC=NC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)Br)C4=CC=NC=C4

InChI

InChI=1S/C22H19BrN4S/c1-2-16-5-9-20(10-6-16)27-21(18-11-13-24-14-12-18)25-26-22(27)28-15-17-3-7-19(23)8-4-17/h3-14H,2,15H2,1H3