1-bromanyl-4-chloranyl-hexane; [3-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-oxidanylidene-1,3-diazinan-1-yl] ethanoate

Systemtic Name: 1-bromanyl-4-chloranyl-hexane; [3-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-oxidanylidene-1,3-diazinan-1-yl] ethanoate Openeye Name: 1-bromo-4-chloro-hexane; [3-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-oxo-hexahydropyrimidin-1-yl] acetate CAS Name: acetic acid [3-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,3-diazinan-1-yl] ester; 1-bromo-4-chlorohexane IUPAC Name: 1-bromo-4-chlorohexane; [3-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,3-diazinan-1-yl] acetate Traditional Name: acetic acid [3-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-keto-hexahydropyrimidin-1-yl] ester; 1-bromo-4-chloro-hexane Formula: C20H32BrClN4O3S MolecularWeight: 523.91508

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCBr)Cl.CC(=O)ON1CCCN(C1=O)C2=NN=C(S2)C3CCCCC3

Isomeric SMILES

CCC(CCCBr)Cl.CC(=O)ON1CCCN(C1=O)C2=NN=C(S2)C3CCCCC3

InChI

InChI=1S/C14H20N4O3S.C6H12BrCl/c1-10(19)21-18-9-5-8-17(14(18)20)13-16-15-12(22-13)11-6-3-2-4-7-11;1-2-6(8)4-3-5-7/h11H,2-9H2,1H3;6H,2-5H2,1H3