(3S)-3-[[2-(methylcarbamoylamino)-2-thiophen-2-yl-ethanoyl]amino]-2-oxidanylidene-azetidine-1-sulfonic acid

Systemtic Name: (3S)-3-[[2-(methylcarbamoylamino)-2-thiophen-2-yl-ethanoyl]amino]-2-oxidanylidene-azetidine-1-sulfonic acid Openeye Name: (3S)-3-[[2-(methylcarbamoylamino)-2-(2-thienyl)acetyl]amino]-2-oxo-azetidine-1-sulfonic acid CAS Name: (3S)-3-[[2-(methylcarbamoylamino)-1-oxo-2-thiophen-2-ylethyl]amino]-2-oxo-1-azetidinesulfonic acid IUPAC Name: (3S)-3-[[2-(methylcarbamoylamino)-2-thiophen-2-ylacetyl]amino]-2-oxoazetidine-1-sulfonic acid Traditional Name: (3S)-2-keto-3-[[2-(methylcarbamoylamino)-2-(2-thienyl)acetyl]amino]azetidine-1-sulfonic acid Formula: C11H14N4O6S2 MolecularWeight: 362.38206

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(C1=CC=CS1)C(=O)NC2CN(C2=O)S(=O)(=O)O

Isomeric SMILES

CNC(=O)NC(C1=CC=CS1)C(=O)N[C@H]2CN(C2=O)S(=O)(=O)O

InChI

InChI=1S/C11H14N4O6S2/c1-12-11(18)14-8(7-3-2-4-22-7)9(16)13-6-5-15(10(6)17)23(19,20)21/h2-4,6,8H,5H2,1H3,(H,13,16)(H2,12,14,18)(H,19,20,21)/t6-,8?/m0/s1