4-[[5-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1,3,4-thiadiazol-2-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[5-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1,3,4-thiadiazol-2-yl]amino]benzenesulfonamide Openeye Name: 4-[[5-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1,3,4-thiadiazol-2-yl]amino]benzenesulfonamide CAS Name: 4-[[5-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-1,3,4-thiadiazol-2-yl]amino]benzenesulfonamide IUPAC Name: 4-[[5-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1,3,4-thiadiazol-2-yl]amino]benzenesulfonamide Traditional Name: 4-[[5-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-1,3,4-thiadiazol-2-yl]amino]benzenesulfonamide Formula: C15H16N6O2S3 MolecularWeight: 408.52154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=NN=C(S2)NC3=CC=C(C=C3)S(=O)(=O)N)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=NN=C(S2)NC3=CC=C(C=C3)S(=O)(=O)N)C

InChI

InChI=1S/C15H16N6O2S3/c1-9-7-10(2)18-14(17-9)24-8-13-20-21-15(25-13)19-11-3-5-12(6-4-11)26(16,22)23/h3-7H,8H2,1-2H3,(H,19,21)(H2,16,22,23)