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

Systemtic Name: 4-[5-[(3-bromophenyl)methylsulfanyl]-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-[(3-bromophenyl)methylsulfanyl]-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[(3-bromophenyl)methylthio]-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[(3-bromophenyl)methylsulfanyl]-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-[(3-bromobenzyl)thio]-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]pyridine Formula: C17H17BrN4OS MolecularWeight: 405.31208

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=NN=C1SCC2=CC(=CC=C2)Br)C3=CC=NC=C3

Isomeric SMILES

COCCN1C(=NN=C1SCC2=CC(=CC=C2)Br)C3=CC=NC=C3

InChI

InChI=1S/C17H17BrN4OS/c1-23-10-9-22-16(14-5-7-19-8-6-14)20-21-17(22)24-12-13-3-2-4-15(18)11-13/h2-8,11H,9-10,12H2,1H3