1-(4-bromophenyl)-2-[[5-(furan-2-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-(4-bromophenyl)-2-[[5-(furan-2-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Openeye Name: 1-(4-bromophenyl)-2-[[5-(2-furylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone CAS Name: 1-(4-bromophenyl)-2-[[5-(2-furanylmethylamino)-1,3,4-thiadiazol-2-yl]thio]ethanone IUPAC Name: 1-(4-bromophenyl)-2-[[5-(furan-2-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Traditional Name: 1-(4-bromophenyl)-2-[[5-(2-furfurylamino)-1,3,4-thiadiazol-2-yl]thio]ethanone Formula: C15H12BrN3O2S2 MolecularWeight: 410.30868

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC2=NN=C(S2)SCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=COC(=C1)CNC2=NN=C(S2)SCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C15H12BrN3O2S2/c16-11-5-3-10(4-6-11)13(20)9-22-15-19-18-14(23-15)17-8-12-2-1-7-21-12/h1-7H,8-9H2,(H,17,18)