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

Systemtic Name: butyl 2-[[(2S)-2-acetamido-3-methyl-3-nitrososulfanyl-butanoyl]amino]ethanoate Openeye Name: butyl 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 butyl ester IUPAC Name: butyl 2-[[(2S)-2-acetamido-3-methyl-3-nitrososulfanylbutanoyl]amino]acetate Traditional Name: 2-[[(2S)-2-acetamido-3-methyl-3-(nitrosothio)butanoyl]amino]acetic acid butyl ester Formula: C13H23N3O5S MolecularWeight: 333.40382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H23N3O5S/c1-5-6-7-21-10(18)8-14-12(19)11(15-9(2)17)13(3,4)22-16-20/h11H,5-8H2,1-4H3,(H,14,19)(H,15,17)/t11-/m0/s1