1-[[5-(4-bromanylthiophen-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propan-2-one

Systemtic Name: 1-[[5-(4-bromanylthiophen-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propan-2-one Openeye Name: 1-[[5-(4-bromo-2-thienyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propan-2-one CAS Name: 1-[[5-(4-bromo-2-thiophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-2-propanone IUPAC Name: 1-[[5-(4-bromothiophen-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propan-2-one Traditional Name: 1-[[5-(4-bromo-2-thienyl)-4-methyl-1,2,4-triazol-3-yl]thio]acetone Formula: C10H10BrN3OS2 MolecularWeight: 332.2399

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NN=C(N1C)C2=CC(=CS2)Br

Isomeric SMILES

CC(=O)CSC1=NN=C(N1C)C2=CC(=CS2)Br

InChI

InChI=1S/C10H10BrN3OS2/c1-6(15)4-17-10-13-12-9(14(10)2)8-3-7(11)5-16-8/h3,5H,4H2,1-2H3