2-azaniumyl-5-[[1-[(2-azanyl-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-3-sulfanyl-propan-2-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 2-azaniumyl-5-[[1-[(2-azanyl-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-3-sulfanyl-propan-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: 5-[[2-[(2-amino-2-oxo-ethyl)amino]-2-oxo-1-(sulfanylmethyl)ethyl]amino]-2-azaniumyl-5-oxo-pentanoate CAS Name: 5-[[1-[(2-amino-2-oxoethyl)amino]-3-mercapto-1-oxopropan-2-yl]amino]-2-ammonio-5-oxopentanoate IUPAC Name: 5-[[1-[(2-amino-2-oxoethyl)amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-2-azaniumyl-5-oxopentanoate Traditional Name: 5-[[2-[(2-amino-2-keto-ethyl)amino]-2-keto-1-(mercaptomethyl)ethyl]amino]-2-ammonio-5-keto-valerate Formula: C10H18N4O5S MolecularWeight: 306.33872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H18N4O5S/c11-5(10(18)19)1-2-8(16)14-6(4-20)9(17)13-3-7(12)15/h5-6,20H,1-4,11H2,(H2,12,15)(H,13,17)(H,14,16)(H,18,19)