1-(1,3-benzothiazol-2-yl)-1,3-dimethyl-urea; 2-[2,4-bis(chloranyl)phenoxy]propanoic acid

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-1,3-dimethyl-urea; 2-[2,4-bis(chloranyl)phenoxy]propanoic acid Openeye Name: 1-(1,3-benzothiazol-2-yl)-1,3-dimethyl-urea; 2-(2,4-dichlorophenoxy)propanoic acid CAS Name: 1-(1,3-benzothiazol-2-yl)-1,3-dimethylurea; 2-(2,4-dichlorophenoxy)propanoic acid IUPAC Name: 1-(1,3-benzothiazol-2-yl)-1,3-dimethylurea; 2-(2,4-dichlorophenoxy)propanoic acid Traditional Name: 1-(1,3-benzothiazol-2-yl)-1,3-dimethyl-urea; 2-(2,4-dichlorophenoxy)propionic acid Formula: C19H19Cl2N3O4S MolecularWeight: 456.34286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=C(C=C(C=C1)Cl)Cl.CNC(=O)N(C)C1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C(=O)O)OC1=C(C=C(C=C1)Cl)Cl.CNC(=O)N(C)C1=NC2=CC=CC=C2S1

InChI

InChI=1S/C10H11N3OS.C9H8Cl2O3/c1-11-9(14)13(2)10-12-7-5-3-4-6-8(7)15-10;1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h3-6H,1-2H3,(H,11,14);2-5H,1H3,(H,12,13)