prop-2-enyl (2E)-2-(dimethylcarbamoylimino)-5-propan-2-ylsulfonyl-1,3,4-thiadiazole-3-carboxylate

Systemtic Name: prop-2-enyl (2E)-2-(dimethylcarbamoylimino)-5-propan-2-ylsulfonyl-1,3,4-thiadiazole-3-carboxylate Openeye Name: allyl (2E)-2-(dimethylcarbamoylimino)-5-isopropylsulfonyl-1,3,4-thiadiazole-3-carboxylate CAS Name: (2E)-2-[dimethylamino(oxo)methyl]imino-5-propan-2-ylsulfonyl-1,3,4-thiadiazole-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2E)-2-(dimethylcarbamoylimino)-5-propan-2-ylsulfonyl-1,3,4-thiadiazole-3-carboxylate Traditional Name: (2E)-2-(dimethylcarbamoylimino)-5-isopropylsulfonyl-1,3,4-thiadiazole-3-carboxylic acid allyl ester Formula: C12H18N4O5S2 MolecularWeight: 362.42512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=NN(C(=NC(=O)N(C)C)S1)C(=O)OCC=C

Isomeric SMILES

CC(C)S(=O)(=O)C1=NN(/C(=N\C(=O)N(C)C)/S1)C(=O)OCC=C

InChI

InChI=1S/C12H18N4O5S2/c1-6-7-21-12(18)16-10(13-9(17)15(4)5)22-11(14-16)23(19,20)8(2)3/h6,8H,1,7H2,2-5H3/b13-10+