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

Systemtic Name: 3-[[2-[[2-(aminocarbonylamino)-2-thiophen-2-yl-ethanoyl]amino]-2-phenyl-ethanoyl]amino]-2-oxidanylidene-azetidine-1-sulfonic acid Openeye Name: 2-oxo-3-[[2-phenyl-2-[[2-(2-thienyl)-2-ureido-acetyl]amino]acetyl]amino]azetidine-1-sulfonic acid CAS Name: 3-[[2-[[2-(carbamoylamino)-1-oxo-2-thiophen-2-ylethyl]amino]-1-oxo-2-phenylethyl]amino]-2-oxo-1-azetidinesulfonic acid IUPAC Name: 3-[[2-[[2-(carbamoylamino)-2-thiophen-2-ylacetyl]amino]-2-phenylacetyl]amino]-2-oxoazetidine-1-sulfonic acid Traditional Name: 2-keto-3-[[2-phenyl-2-[[2-(2-thienyl)-2-ureido-acetyl]amino]acetyl]amino]azetidine-1-sulfonic acid Formula: C18H19N5O7S2 MolecularWeight: 481.50276

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N1S(=O)(=O)O)NC(=O)C(C2=CC=CC=C2)NC(=O)C(C3=CC=CS3)NC(=O)N

Isomeric SMILES

C1C(C(=O)N1S(=O)(=O)O)NC(=O)C(C2=CC=CC=C2)NC(=O)C(C3=CC=CS3)NC(=O)N

InChI

InChI=1S/C18H19N5O7S2/c19-18(27)22-14(12-7-4-8-31-12)16(25)21-13(10-5-2-1-3-6-10)15(24)20-11-9-23(17(11)26)32(28,29)30/h1-8,11,13-14H,9H2,(H,20,24)(H,21,25)(H3,19,22,27)(H,28,29,30)