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

Systemtic Name: ethyl 5-[(2S,3R,4S)-4-(aminocarbonylamino)-3-oxidanyl-thiolan-2-yl]pentanoate Openeye Name: ethyl 5-[(2S,3R,4S)-3-hydroxy-4-ureido-tetrahydrothiophen-2-yl]pentanoate CAS Name: 5-[(2S,3R,4S)-4-(carbamoylamino)-3-hydroxy-2-thiolanyl]pentanoic acid ethyl ester IUPAC Name: ethyl 5-[(2S,3R,4S)-4-(carbamoylamino)-3-hydroxythiolan-2-yl]pentanoate Traditional Name: 5-[(2S,3R,4S)-3-hydroxy-4-ureido-tetrahydrothiophen-2-yl]valeric acid ethyl ester Formula: C12H22N2O4S MolecularWeight: 290.37908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H22N2O4S/c1-2-18-10(15)6-4-3-5-9-11(16)8(7-19-9)14-12(13)17/h8-9,11,16H,2-7H2,1H3,(H3,13,14,17)/t8-,9+,11-/m1/s1