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

Systemtic Name: prop-2-enyl (2E)-2-(dimethylcarbamoylimino)-5-(2-methylpropylsulfanyl)-1,3,4-thiadiazole-3-carboxylate Openeye Name: allyl (2E)-2-(dimethylcarbamoylimino)-5-isobutylsulfanyl-1,3,4-thiadiazole-3-carboxylate CAS Name: (2E)-2-[dimethylamino(oxo)methyl]imino-5-(2-methylpropylthio)-1,3,4-thiadiazole-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2E)-2-(dimethylcarbamoylimino)-5-(2-methylpropylsulfanyl)-1,3,4-thiadiazole-3-carboxylate Traditional Name: (2E)-2-(dimethylcarbamoylimino)-5-(isobutylthio)-1,3,4-thiadiazole-3-carboxylic acid allyl ester Formula: C13H20N4O3S2 MolecularWeight: 344.4529

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NN(C(=NC(=O)N(C)C)S1)C(=O)OCC=C

Isomeric SMILES

CC(C)CSC1=NN(/C(=N\C(=O)N(C)C)/S1)C(=O)OCC=C

InChI

InChI=1S/C13H20N4O3S2/c1-6-7-20-13(19)17-11(14-10(18)16(4)5)22-12(15-17)21-8-9(2)3/h6,9H,1,7-8H2,2-5H3/b14-11+