1-(3-chloranyl-4-fluoranyl-phenyl)-3-[2-(3,5-dimethylphenoxy)ethanoylamino]thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[2-(3,5-dimethylphenoxy)ethanoylamino]thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-[[2-(3,5-dimethylphenoxy)acetyl]amino]thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[[2-(3,5-dimethylphenoxy)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-[[2-(3,5-dimethylphenoxy)acetyl]amino]thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-[[2-(3,5-dimethylphenoxy)acetyl]amino]thiourea Formula: C17H17ClFN3O2S MolecularWeight: 381.852183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)NNC(=S)NC2=CC(=C(C=C2)F)Cl)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)NNC(=S)NC2=CC(=C(C=C2)F)Cl)C

InChI

InChI=1S/C17H17ClFN3O2S/c1-10-5-11(2)7-13(6-10)24-9-16(23)21-22-17(25)20-12-3-4-15(19)14(18)8-12/h3-8H,9H2,1-2H3,(H,21,23)(H2,20,22,25)