2-[2-[[2-[(2-azanyl-3-sulfanyl-propanoyl)amino]-3-oxidanyl-propanoyl]amino]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[[2-[(2-azanyl-3-sulfanyl-propanoyl)amino]-3-oxidanyl-propanoyl]amino]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[[2-[(2-amino-3-sulfanyl-propanoyl)amino]-3-hydroxy-propanoyl]amino]acetyl]amino]acetic acid CAS Name: 2-[[2-[[2-[(2-amino-3-mercapto-1-oxopropyl)amino]-3-hydroxy-1-oxopropyl]amino]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[[2-[(2-amino-3-sulfanylpropanoyl)amino]-3-hydroxypropanoyl]amino]acetyl]amino]acetic acid Traditional Name: 2-[[2-[[2-[(2-amino-3-mercapto-propanoyl)amino]-3-hydroxy-propanoyl]amino]acetyl]amino]acetic acid Formula: C10H18N4O6S MolecularWeight: 322.33812

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C(=O)NCC(=O)NCC(=O)O)NC(=O)C(CS)N)O

Isomeric SMILES

C(C(C(=O)NCC(=O)NCC(=O)O)NC(=O)C(CS)N)O

InChI

InChI=1S/C10H18N4O6S/c11-5(4-21)9(19)14-6(3-15)10(20)13-1-7(16)12-2-8(17)18/h5-6,15,21H,1-4,11H2,(H,12,16)(H,13,20)(H,14,19)(H,17,18)