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

Systemtic Name: propyl 2-[[(2S)-2-acetamido-3-methyl-3-nitrososulfanyl-butanoyl]amino]ethanoate Openeye Name: propyl 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 propyl ester IUPAC Name: propyl 2-[[(2S)-2-acetamido-3-methyl-3-nitrososulfanylbutanoyl]amino]acetate Traditional Name: 2-[[(2S)-2-acetamido-3-methyl-3-(nitrosothio)butanoyl]amino]acetic acid propyl ester Formula: C12H21N3O5S MolecularWeight: 319.37724

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CNC(=O)C(C(C)(C)SN=O)NC(=O)C

Isomeric SMILES

CCCOC(=O)CNC(=O)[C@@H](C(C)(C)SN=O)NC(=O)C

InChI

InChI=1S/C12H21N3O5S/c1-5-6-20-9(17)7-13-11(18)10(14-8(2)16)12(3,4)21-15-19/h10H,5-7H2,1-4H3,(H,13,18)(H,14,16)/t10-/m0/s1