3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-(furan-2-ylmethyl)-1,2,4-triazole

Systemtic Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-(furan-2-ylmethyl)-1,2,4-triazole Openeye Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-(2-furylmethyl)-1,2,4-triazole CAS Name: 3-[2-(4-bromophenyl)sulfonylethylthio]-4-(2-furanylmethyl)-1,2,4-triazole IUPAC Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-(furan-2-ylmethyl)-1,2,4-triazole Traditional Name: 3-(2-brosylethylthio)-4-(2-furfuryl)-1,2,4-triazole Formula: C15H14BrN3O3S2 MolecularWeight: 428.32396

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN2C=NN=C2SCCS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=COC(=C1)CN2C=NN=C2SCCS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C15H14BrN3O3S2/c16-12-3-5-14(6-4-12)24(20,21)9-8-23-15-18-17-11-19(15)10-13-2-1-7-22-13/h1-7,11H,8-10H2