3-[(3-bromophenyl)methylsulfanyl]-4-(2-methoxyethyl)-1,2,4-triazole

Systemtic Name: 3-[(3-bromophenyl)methylsulfanyl]-4-(2-methoxyethyl)-1,2,4-triazole Openeye Name: 3-[(3-bromophenyl)methylsulfanyl]-4-(2-methoxyethyl)-1,2,4-triazole CAS Name: 3-[(3-bromophenyl)methylthio]-4-(2-methoxyethyl)-1,2,4-triazole IUPAC Name: 3-[(3-bromophenyl)methylsulfanyl]-4-(2-methoxyethyl)-1,2,4-triazole Traditional Name: 3-[(3-bromobenzyl)thio]-4-(2-methoxyethyl)-1,2,4-triazole Formula: C12H14BrN3OS MolecularWeight: 328.22806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14BrN3OS/c1-17-6-5-16-9-14-15-12(16)18-8-10-3-2-4-11(13)7-10/h2-4,7,9H,5-6,8H2,1H3