1-(4-fluorophenyl)-3-[[2-oxidanylidene-5-(trifluoromethyloxy)indol-3-yl]amino]thiourea

Systemtic Name: 1-(4-fluorophenyl)-3-[[2-oxidanylidene-5-(trifluoromethyloxy)indol-3-yl]amino]thiourea Openeye Name: 1-(4-fluorophenyl)-3-[[2-oxo-5-(trifluoromethoxy)indol-3-yl]amino]thiourea CAS Name: 1-(4-fluorophenyl)-3-[[2-oxo-5-(trifluoromethoxy)-3-indolyl]amino]thiourea IUPAC Name: 1-(4-fluorophenyl)-3-[[2-oxo-5-(trifluoromethoxy)indol-3-yl]amino]thiourea Traditional Name: 1-(4-fluorophenyl)-3-[[2-keto-5-(trifluoromethoxy)indol-3-yl]amino]thiourea Formula: C16H10F4N4O2S MolecularWeight: 398.334813

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NNC2=C3C=C(C=CC3=NC2=O)OC(F)(F)F)F

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NNC2=C3C=C(C=CC3=NC2=O)OC(F)(F)F)F

InChI

InChI=1S/C16H10F4N4O2S/c17-8-1-3-9(4-2-8)21-15(27)24-23-13-11-7-10(26-16(18,19)20)5-6-12(11)22-14(13)25/h1-7H,(H2,21,24,27)(H,22,23,25)