1-[(2R)-5-azanyl-2-[(4-bromophenyl)sulfonylmethyl]-2-methyl-1,3,4-thiadiazol-3-yl]ethanone

Systemtic Name: 1-[(2R)-5-azanyl-2-[(4-bromophenyl)sulfonylmethyl]-2-methyl-1,3,4-thiadiazol-3-yl]ethanone Openeye Name: 1-[(2R)-5-amino-2-[(4-bromophenyl)sulfonylmethyl]-2-methyl-1,3,4-thiadiazol-3-yl]ethanone CAS Name: 1-[(2R)-5-amino-2-[(4-bromophenyl)sulfonylmethyl]-2-methyl-1,3,4-thiadiazol-3-yl]ethanone IUPAC Name: 1-[(2R)-5-amino-2-[(4-bromophenyl)sulfonylmethyl]-2-methyl-1,3,4-thiadiazol-3-yl]ethanone Traditional Name: 1-[(2R)-5-amino-2-(brosylmethyl)-2-methyl-1,3,4-thiadiazol-3-yl]ethanone Formula: C12H14BrN3O3S2 MolecularWeight: 392.29186

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(SC(=N1)N)(C)CS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(=O)N1[C@@](SC(=N1)N)(C)CS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C12H14BrN3O3S2/c1-8(17)16-12(2,20-11(14)15-16)7-21(18,19)10-5-3-9(13)4-6-10/h3-6H,7H2,1-2H3,(H2,14,15)/t12-/m1/s1