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N-[(2S,3R,4R,5S,6R)-6-(hydroxymethyl)-2-[2-(3-methyl-1,2-diazirin-3-yl)ethylsulfanyl]-4,5-bis(oxidanyl)oxan-3-yl]ethanamide

N-[(2S,3R,4R,5S,6R)-6-(hydroxymethyl)-2-[2-(3-methyl-1,2-diazirin-3-yl)ethylsulfanyl]-4,5-bis(oxidanyl)oxan-3-yl]ethanamide

Systemtic Name:N-[(2S,3R,4R,5S,6R)-6-(hydroxymethyl)-2-[2-(3-methyl-1,2-diazirin-3-yl)ethylsulfanyl]-4,5-bis(oxidanyl)oxan-3-yl]ethanamide
Openeye Name:N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[2-(3-methyldiazirin-3-yl)ethylsulfanyl]tetrahydropyran-3-yl]acetamide
CAS Name:N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[2-(3-methyl-3-diazirinyl)ethylthio]-3-oxanyl]acetamide
IUPAC Name:N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[2-(3-methyldiazirin-3-yl)ethylsulfanyl]oxan-3-yl]acetamide
Traditional Name:N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-2-[2-(3-methyldiazirin-3-yl)ethylthio]-6-methylol-tetrahydropyran-3-yl]acetamide
Formula: C12H21N3O5S
MolecularWeight: 319.37724
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C(C(OC1SCCC2(N=N2)C)CO)O)O


Isomeric SMILES

CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1SCCC2(N=N2)C)CO)O)O


InChI

InChI=1S/C12H21N3O5S/c1-6(17)13-8-10(19)9(18)7(5-16)20-11(8)21-4-3-12(2)14-15-12/h7-11,16,18-19H,3-5H2,1-2H3,(H,13,17)/t7-,8-,9-,10-,11+/m1/s1


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