2-[[2-[2-(2-azanylpropanoylamino)propanoylamino]-3-sulfanyl-propanoyl]amino]ethanoic acid

Systemtic Name: 2-[[2-[2-(2-azanylpropanoylamino)propanoylamino]-3-sulfanyl-propanoyl]amino]ethanoic acid Openeye Name: 2-[[2-[2-(2-aminopropanoylamino)propanoylamino]-3-sulfanyl-propanoyl]amino]acetic acid CAS Name: 2-[[2-[[2-[(2-amino-1-oxopropyl)amino]-1-oxopropyl]amino]-3-mercapto-1-oxopropyl]amino]acetic acid IUPAC Name: 2-[[2-[2-(2-aminopropanoylamino)propanoylamino]-3-sulfanylpropanoyl]amino]acetic acid Traditional Name: 2-[[2-[2-(alanylamino)propanoylamino]-3-mercapto-propanoyl]amino]acetic acid Formula: C11H20N4O5S MolecularWeight: 320.3653

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H20N4O5S/c1-5(12)9(18)14-6(2)10(19)15-7(4-21)11(20)13-3-8(16)17/h5-7,21H,3-4,12H2,1-2H3,(H,13,20)(H,14,18)(H,15,19)(H,16,17)