1-tert-butyl-3-[3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]propanoylamino]thiourea

Systemtic Name: 1-tert-butyl-3-[3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]propanoylamino]thiourea Openeye Name: 1-tert-butyl-3-[3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]propanoylamino]thiourea CAS Name: 1-tert-butyl-3-[[3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1-oxopropyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]propanoylamino]thiourea Traditional Name: 1-tert-butyl-3-[3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]propanoylamino]thiourea Formula: C16H20FN5O2S MolecularWeight: 365.425703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NNC(=O)CCC1=NC(=NO1)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C)NC(=S)NNC(=O)CCC1=NC(=NO1)C2=CC=C(C=C2)F

InChI

InChI=1S/C16H20FN5O2S/c1-16(2,3)19-15(25)21-20-12(23)8-9-13-18-14(22-24-13)10-4-6-11(17)7-5-10/h4-7H,8-9H2,1-3H3,(H,20,23)(H2,19,21,25)