[3-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)-2-oxidanylidene-1-(trichloromethyl)-1,3-diazinan-4-yl] 2-chloranylethanoate

Systemtic Name: [3-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)-2-oxidanylidene-1-(trichloromethyl)-1,3-diazinan-4-yl] 2-chloranylethanoate Openeye Name: [3-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)-2-oxo-1-(trichloromethyl)hexahydropyrimidin-4-yl] 2-chloroacetate CAS Name: 2-chloroacetic acid [3-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)-2-oxo-1-(trichloromethyl)-1,3-diazinan-4-yl] ester IUPAC Name: [3-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)-2-oxo-1-(trichloromethyl)-1,3-diazinan-4-yl] 2-chloroacetate Traditional Name: 2-chloroacetic acid [3-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)-2-keto-1-(trichloromethyl)hexahydropyrimidin-4-yl] ester Formula: C14H16Cl4N4O3S MolecularWeight: 462.17884

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=NN=C(S2)N3C(CCN(C3=O)C(Cl)(Cl)Cl)OC(=O)CCl

Isomeric SMILES

C1CCC(C1)C2=NN=C(S2)N3C(CCN(C3=O)C(Cl)(Cl)Cl)OC(=O)CCl

InChI

InChI=1S/C14H16Cl4N4O3S/c15-7-10(23)25-9-5-6-21(14(16,17)18)13(24)22(9)12-20-19-11(26-12)8-3-1-2-4-8/h8-9H,1-7H2