methyl 2-[[(2S)-2-acetamido-3-methyl-3-nitrososulfanyl-butanoyl]amino]ethanoate

Systemtic Name: methyl 2-[[(2S)-2-acetamido-3-methyl-3-nitrososulfanyl-butanoyl]amino]ethanoate Openeye Name: methyl 2-[[(2S)-2-acetamido-3-methyl-3-nitrososulfanyl-butanoyl]amino]acetate CAS Name: 2-[[(2S)-2-acetamido-3-methyl-3-(nitrosothio)-1-oxobutyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[(2S)-2-acetamido-3-methyl-3-nitrososulfanylbutanoyl]amino]acetate Traditional Name: 2-[[(2S)-2-acetamido-3-methyl-3-(nitrosothio)butanoyl]amino]acetic acid methyl ester Formula: C10H17N3O5S MolecularWeight: 291.32408

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C(=O)NCC(=O)OC)C(C)(C)SN=O

Isomeric SMILES

CC(=O)N[C@@H](C(=O)NCC(=O)OC)C(C)(C)SN=O

InChI

InChI=1S/C10H17N3O5S/c1-6(14)12-8(10(2,3)19-13-17)9(16)11-5-7(15)18-4/h8H,5H2,1-4H3,(H,11,16)(H,12,14)/t8-/m0/s1