2-[[4-methyl-2,3-bis(oxidanylidene)piperazin-1-yl]carbonylamino]-2-thiophen-2-yl-ethanoic acid

Systemtic Name: 2-[[4-methyl-2,3-bis(oxidanylidene)piperazin-1-yl]carbonylamino]-2-thiophen-2-yl-ethanoic acid Openeye Name: 2-[(4-methyl-2,3-dioxo-piperazine-1-carbonyl)amino]-2-(2-thienyl)acetic acid CAS Name: 2-[[(4-methyl-2,3-dioxo-1-piperazinyl)-oxomethyl]amino]-2-thiophen-2-ylacetic acid IUPAC Name: 2-[(4-methyl-2,3-dioxopiperazine-1-carbonyl)amino]-2-thiophen-2-ylacetic acid Traditional Name: 2-[(2,3-diketo-4-methyl-piperazine-1-carbonyl)amino]-2-(2-thienyl)acetic acid Formula: C12H13N3O5S MolecularWeight: 311.31372

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C(=O)C1=O)C(=O)NC(C2=CC=CS2)C(=O)O

Isomeric SMILES

CN1CCN(C(=O)C1=O)C(=O)NC(C2=CC=CS2)C(=O)O

InChI

InChI=1S/C12H13N3O5S/c1-14-4-5-15(10(17)9(14)16)12(20)13-8(11(18)19)7-3-2-6-21-7/h2-3,6,8H,4-5H2,1H3,(H,13,20)(H,18,19)