3-[2-[2-(2-chloranylethanoylamino)-1,3-thiazol-4-yl]ethanoylamino]-4-oxidanylidene-azetidine-2-carboxylic acid

Systemtic Name: 3-[2-[2-(2-chloranylethanoylamino)-1,3-thiazol-4-yl]ethanoylamino]-4-oxidanylidene-azetidine-2-carboxylic acid Openeye Name: 3-[[2-[2-[(2-chloroacetyl)amino]thiazol-4-yl]acetyl]amino]-4-oxo-azetidine-2-carboxylic acid CAS Name: 3-[[2-[2-[(2-chloro-1-oxoethyl)amino]-4-thiazolyl]-1-oxoethyl]amino]-4-oxo-2-azetidinecarboxylic acid IUPAC Name: 3-[[2-[2-[(2-chloroacetyl)amino]-1,3-thiazol-4-yl]acetyl]amino]-4-oxoazetidine-2-carboxylic acid Traditional Name: 3-[[2-[2-[(2-chloroacetyl)amino]thiazol-4-yl]acetyl]amino]-4-keto-azetidine-2-carboxylic acid Formula: C11H11ClN4O5S MolecularWeight: 346.74684

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=C(S1)NC(=O)CCl)CC(=O)NC2C(NC2=O)C(=O)O

Isomeric SMILES

C1=C(N=C(S1)NC(=O)CCl)CC(=O)NC2C(NC2=O)C(=O)O

InChI

InChI=1S/C11H11ClN4O5S/c12-2-6(18)15-11-13-4(3-22-11)1-5(17)14-7-8(10(20)21)16-9(7)19/h3,7-8H,1-2H2,(H,14,17)(H,16,19)(H,20,21)(H,13,15,18)