2-[3-[2-(iodanylmethyl)-4-oxidanylidene-2-(2-thiophen-2-ylethanoylamino)azetidin-1-yl]phenyl]carbothioyloxyethanoic acid

Systemtic Name: 2-[3-[2-(iodanylmethyl)-4-oxidanylidene-2-(2-thiophen-2-ylethanoylamino)azetidin-1-yl]phenyl]carbothioyloxyethanoic acid Openeye Name: 2-[3-[2-(iodomethyl)-4-oxo-2-[[2-(2-thienyl)acetyl]amino]azetidin-1-yl]benzenecarbothioyl]oxyacetic acid CAS Name: 2-[[3-[2-(iodomethyl)-4-oxo-2-[(1-oxo-2-thiophen-2-ylethyl)amino]-1-azetidinyl]phenyl]-sulfanylidenemethoxy]acetic acid IUPAC Name: 2-[3-[2-(iodomethyl)-4-oxo-2-[(2-thiophen-2-ylacetyl)amino]azetidin-1-yl]benzenecarbothioyl]oxyacetic acid Traditional Name: 2-[3-[2-(iodomethyl)-4-keto-2-[[2-(2-thienyl)acetyl]amino]azetidin-1-yl]thiobenzoyl]oxyacetic acid Formula: C19H17IN2O5S2 MolecularWeight: 544.38315

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C1(CI)NC(=O)CC2=CC=CS2)C3=CC=CC(=C3)C(=S)OCC(=O)O

Isomeric SMILES

C1C(=O)N(C1(CI)NC(=O)CC2=CC=CS2)C3=CC=CC(=C3)C(=S)OCC(=O)O

InChI

InChI=1S/C19H17IN2O5S2/c20-11-19(21-15(23)8-14-5-2-6-29-14)9-16(24)22(19)13-4-1-3-12(7-13)18(28)27-10-17(25)26/h1-7H,8-11H2,(H,21,23)(H,25,26)