methyl 5-[(2R,3S,4R)-3,4-bis(aminocarbonylamino)thiolan-2-yl]pentanoate

Systemtic Name: methyl 5-[(2R,3S,4R)-3,4-bis(aminocarbonylamino)thiolan-2-yl]pentanoate Openeye Name: methyl 5-[(2R,3S,4R)-3,4-diureidotetrahydrothiophen-2-yl]pentanoate CAS Name: 5-[(2R,3S,4R)-3,4-bis(carbamoylamino)-2-thiolanyl]pentanoic acid methyl ester IUPAC Name: methyl 5-[(2R,3S,4R)-3,4-bis(carbamoylamino)thiolan-2-yl]pentanoate Traditional Name: 5-[(2R,3S,4R)-3,4-diureidotetrahydrothiophen-2-yl]valeric acid methyl ester Formula: C12H22N4O4S MolecularWeight: 318.39248

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC1C(C(CS1)NC(=O)N)NC(=O)N

Isomeric SMILES

COC(=O)CCCC[C@@H]1[C@H]([C@H](CS1)NC(=O)N)NC(=O)N

InChI

InChI=1S/C12H22N4O4S/c1-20-9(17)5-3-2-4-8-10(16-12(14)19)7(6-21-8)15-11(13)18/h7-8,10H,2-6H2,1H3,(H3,13,15,18)(H3,14,16,19)/t7-,8+,10-/m0/s1