[3-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-2-oxidanylidene-1-propyl-1,3-diazinan-4-yl] butanoate

Systemtic Name: [3-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-2-oxidanylidene-1-propyl-1,3-diazinan-4-yl] butanoate Openeye Name: [3-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-2-oxo-1-propyl-hexahydropyrimidin-4-yl] butanoate CAS Name: butanoic acid [3-[5-(methylthio)-1,3,4-thiadiazol-2-yl]-2-oxo-1-propyl-1,3-diazinan-4-yl] ester IUPAC Name: [3-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-2-oxo-1-propyl-1,3-diazinan-4-yl] butanoate Traditional Name: butyric acid [2-keto-3-[5-(methylthio)-1,3,4-thiadiazol-2-yl]-1-propyl-hexahydropyrimidin-4-yl] ester Formula: C14H22N4O3S2 MolecularWeight: 358.47948

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1CCN(C(=O)N1C2=NN=C(S2)SC)CCC

Isomeric SMILES

CCCC(=O)OC1CCN(C(=O)N1C2=NN=C(S2)SC)CCC

InChI

InChI=1S/C14H22N4O3S2/c1-4-6-11(19)21-10-7-9-17(8-5-2)14(20)18(10)12-15-16-13(22-3)23-12/h10H,4-9H2,1-3H3