(2R)-2-azaniumyl-5-[[(2S)-3-nitrososulfanyl-1-[(2-oxidanidyl-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: (2R)-2-azaniumyl-5-[[(2S)-3-nitrososulfanyl-1-[(2-oxidanidyl-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: (2R)-2-azaniumyl-5-[[(1S)-1-(nitrososulfanylmethyl)-2-[(2-oxido-2-oxo-ethyl)amino]-2-oxo-ethyl]amino]-5-oxo-pentanoate CAS Name: (2R)-2-ammonio-5-[[(2S)-3-(nitrosothio)-1-[(2-oxido-2-oxoethyl)amino]-1-oxopropan-2-yl]amino]-5-oxopentanoate IUPAC Name: (2R)-2-azaniumyl-5-[[(2S)-3-nitrososulfanyl-1-[(2-oxido-2-oxoethyl)amino]-1-oxopropan-2-yl]amino]-5-oxopentanoate Traditional Name: (2R)-2-ammonio-5-keto-5-[[(1S)-2-keto-2-[(2-keto-2-oxido-ethyl)amino]-1-[(nitrosothio)methyl]ethyl]amino]valerate Formula: C10H15N4O7S- MolecularWeight: 335.3137

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)NC(CSN=O)C(=O)NCC(=O)[O-])C(C(=O)[O-])[NH3+]

Isomeric SMILES

C(CC(=O)N[C@H](CSN=O)C(=O)NCC(=O)[O-])[C@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C10H16N4O7S/c11-5(10(19)20)1-2-7(15)13-6(4-22-14-21)9(18)12-3-8(16)17/h5-6H,1-4,11H2,(H,12,18)(H,13,15)(H,16,17)(H,19,20)/p-1/t5-,6-/m1/s1