propan-2-yl (2E)-2-(dimethylcarbamoylimino)-5-hexylsulfonyl-1,3,4-thiadiazole-3-carboxylate

Systemtic Name: propan-2-yl (2E)-2-(dimethylcarbamoylimino)-5-hexylsulfonyl-1,3,4-thiadiazole-3-carboxylate Openeye Name: isopropyl (2E)-2-(dimethylcarbamoylimino)-5-hexylsulfonyl-1,3,4-thiadiazole-3-carboxylate CAS Name: (2E)-2-[dimethylamino(oxo)methyl]imino-5-hexylsulfonyl-1,3,4-thiadiazole-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (2E)-2-(dimethylcarbamoylimino)-5-hexylsulfonyl-1,3,4-thiadiazole-3-carboxylate Traditional Name: (2E)-2-(dimethylcarbamoylimino)-5-hexylsulfonyl-1,3,4-thiadiazole-3-carboxylic acid isopropyl ester Formula: C15H26N4O5S2 MolecularWeight: 406.52074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCS(=O)(=O)C1=NN(C(=NC(=O)N(C)C)S1)C(=O)OC(C)C

Isomeric SMILES

CCCCCCS(=O)(=O)C1=NN(/C(=N\C(=O)N(C)C)/S1)C(=O)OC(C)C

InChI

InChI=1S/C15H26N4O5S2/c1-6-7-8-9-10-26(22,23)14-17-19(15(21)24-11(2)3)13(25-14)16-12(20)18(4)5/h11H,6-10H2,1-5H3/b16-13+