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

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-1-[2-(3,4-dimethoxyphenyl)ethanoylamino]thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-1-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-1-[[2-(3,4-dimethoxyphenyl)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-1-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-1-(homoveratroylamino)thiourea Formula: C17H17ClFN3O3S MolecularWeight: 397.851583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NN(C2=CC(=C(C=C2)F)Cl)C(=S)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NN(C2=CC(=C(C=C2)F)Cl)C(=S)N)OC

InChI

InChI=1S/C17H17ClFN3O3S/c1-24-14-6-3-10(7-15(14)25-2)8-16(23)21-22(17(20)26)11-4-5-13(19)12(18)9-11/h3-7,9H,8H2,1-2H3,(H2,20,26)(H,21,23)