1-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]-3-(3,4-dimethylphenyl)thiourea

Systemtic Name: 1-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]-3-(3,4-dimethylphenyl)thiourea Openeye Name: 1-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]-3-(3,4-dimethylphenyl)thiourea CAS Name: 1-[[2-(4-bromo-2-fluorophenoxy)-1-oxoethyl]amino]-3-(3,4-dimethylphenyl)thiourea IUPAC Name: 1-[[2-(4-bromo-2-fluorophenoxy)acetyl]amino]-3-(3,4-dimethylphenyl)thiourea Traditional Name: 1-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]-3-(3,4-dimethylphenyl)thiourea Formula: C17H17BrFN3O2S MolecularWeight: 426.303183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC(=O)COC2=C(C=C(C=C2)Br)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC(=O)COC2=C(C=C(C=C2)Br)F)C

InChI

InChI=1S/C17H17BrFN3O2S/c1-10-3-5-13(7-11(10)2)20-17(25)22-21-16(23)9-24-15-6-4-12(18)8-14(15)19/h3-8H,9H2,1-2H3,(H,21,23)(H2,20,22,25)