3-[(3-bromophenyl)methylsulfanyl]-5-(thiophen-2-ylmethyl)-1H-1,2,4-triazole

Systemtic Name: 3-[(3-bromophenyl)methylsulfanyl]-5-(thiophen-2-ylmethyl)-1H-1,2,4-triazole Openeye Name: 3-[(3-bromophenyl)methylsulfanyl]-5-(2-thienylmethyl)-1H-1,2,4-triazole CAS Name: 3-[(3-bromophenyl)methylthio]-5-(thiophen-2-ylmethyl)-1H-1,2,4-triazole IUPAC Name: 3-[(3-bromophenyl)methylsulfanyl]-5-(thiophen-2-ylmethyl)-1H-1,2,4-triazole Traditional Name: 3-[(3-bromobenzyl)thio]-5-(2-thenyl)-1H-1,2,4-triazole Formula: C14H12BrN3S2 MolecularWeight: 366.29918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CSC2=NNC(=N2)CC3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)Br)CSC2=NNC(=N2)CC3=CC=CS3

InChI

InChI=1S/C14H12BrN3S2/c15-11-4-1-3-10(7-11)9-20-14-16-13(17-18-14)8-12-5-2-6-19-12/h1-7H,8-9H2,(H,16,17,18)