2-azido-3-[[2-[[4-ethyl-2,3-bis(oxidanylidene)piperazin-1-yl]carbonylamino]-2-thiophen-2-yl-ethanoyl]amino]-4-oxidanylidene-azetidine-1-sulfonate

Systemtic Name: 2-azido-3-[[2-[[4-ethyl-2,3-bis(oxidanylidene)piperazin-1-yl]carbonylamino]-2-thiophen-2-yl-ethanoyl]amino]-4-oxidanylidene-azetidine-1-sulfonate Openeye Name: 2-azido-3-[[2-[(4-ethyl-2,3-dioxo-piperazine-1-carbonyl)amino]-2-(2-thienyl)acetyl]amino]-4-oxo-azetidine-1-sulfonate CAS Name: 2-azido-3-[[2-[[(4-ethyl-2,3-dioxo-1-piperazinyl)-oxomethyl]amino]-1-oxo-2-thiophen-2-ylethyl]amino]-4-oxo-1-azetidinesulfonate IUPAC Name: 2-azido-3-[[2-[(4-ethyl-2,3-dioxopiperazine-1-carbonyl)amino]-2-thiophen-2-ylacetyl]amino]-4-oxoazetidine-1-sulfonate Traditional Name: 2-azido-3-[[2-[(4-ethyl-2,3-diketo-piperazine-1-carbonyl)amino]-2-(2-thienyl)acetyl]amino]-4-keto-azetidine-1-sulfonate Formula: C16H17N8O8S2- MolecularWeight: 513.48498

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(C(=O)C1=O)C(=O)NC(C2=CC=CS2)C(=O)NC3C(N(C3=O)S(=O)(=O)[O-])N=[N+]=[N-]

Isomeric SMILES

CCN1CCN(C(=O)C1=O)C(=O)NC(C2=CC=CS2)C(=O)NC3C(N(C3=O)S(=O)(=O)[O-])N=[N+]=[N-]

InChI

InChI=1S/C16H18N8O8S2/c1-2-22-5-6-23(15(28)14(22)27)16(29)19-9(8-4-3-7-33-8)12(25)18-10-11(20-21-17)24(13(10)26)34(30,31)32/h3-4,7,9-11H,2,5-6H2,1H3,(H,18,25)(H,19,29)(H,30,31,32)/p-1