3-(5-iodanyl-1,3-thiazol-2-yl)-1-(2-oxidanylideneethyl)-1-prop-2-ynyl-urea

Systemtic Name: 3-(5-iodanyl-1,3-thiazol-2-yl)-1-(2-oxidanylideneethyl)-1-prop-2-ynyl-urea Openeye Name: 3-(5-iodothiazol-2-yl)-1-(2-oxoethyl)-1-prop-2-ynyl-urea CAS Name: 3-(5-iodo-2-thiazolyl)-1-(2-oxoethyl)-1-prop-2-ynylurea IUPAC Name: 3-(5-iodo-1,3-thiazol-2-yl)-1-(2-oxoethyl)-1-prop-2-ynylurea Traditional Name: 3-(5-iodothiazol-2-yl)-1-(2-ketoethyl)-1-propargyl-urea Formula: C9H8IN3O2S MolecularWeight: 349.14819

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(CC=O)C(=O)NC1=NC=C(S1)I

Isomeric SMILES

C#CCN(CC=O)C(=O)NC1=NC=C(S1)I

InChI

InChI=1S/C9H8IN3O2S/c1-2-3-13(4-5-14)9(15)12-8-11-6-7(10)16-8/h1,5-6H,3-4H2,(H,11,12,15)