2-acetyloxy-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-acetyloxy-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-acetoxy-3-[[2-[(4-ethyl-2,3-dioxo-piperazine-1-carbonyl)amino]-2-(2-thienyl)acetyl]amino]-4-oxo-azetidine-1-sulfonate CAS Name: 2-acetyloxy-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-acetyloxy-3-[[2-[(4-ethyl-2,3-dioxopiperazine-1-carbonyl)amino]-2-thiophen-2-ylacetyl]amino]-4-oxoazetidine-1-sulfonate Traditional Name: 2-acetoxy-3-[[2-[(4-ethyl-2,3-diketo-piperazine-1-carbonyl)amino]-2-(2-thienyl)acetyl]amino]-4-keto-azetidine-1-sulfonate Formula: C18H20N5O10S2- MolecularWeight: 530.5089

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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-])OC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C18H21N5O10S2/c1-3-21-6-7-22(16(28)15(21)27)18(29)20-11(10-5-4-8-34-10)13(25)19-12-14(26)23(35(30,31)32)17(12)33-9(2)24/h4-5,8,11-12,17H,3,6-7H2,1-2H3,(H,19,25)(H,20,29)(H,30,31,32)/p-1