1-(2-fluoranyl-4-iodanyl-phenyl)-3-[(1S,5S)-3,3,5-trimethylcyclohexyl]thiourea

Systemtic Name: 1-(2-fluoranyl-4-iodanyl-phenyl)-3-[(1S,5S)-3,3,5-trimethylcyclohexyl]thiourea Openeye Name: 1-(2-fluoro-4-iodo-phenyl)-3-[(1S,5S)-3,3,5-trimethylcyclohexyl]thiourea CAS Name: 1-(2-fluoro-4-iodophenyl)-3-[(1S,5S)-3,3,5-trimethylcyclohexyl]thiourea IUPAC Name: 1-(2-fluoro-4-iodophenyl)-3-[(1S,5S)-3,3,5-trimethylcyclohexyl]thiourea Traditional Name: 1-(2-fluoro-4-iodo-phenyl)-3-[(1S,5S)-3,3,5-trimethylcyclohexyl]thiourea Formula: C16H22FIN2S MolecularWeight: 420.327153

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)NC(=S)NC2=C(C=C(C=C2)I)F

Isomeric SMILES

C[C@@H]1C[C@@H](CC(C1)(C)C)NC(=S)NC2=C(C=C(C=C2)I)F

InChI

InChI=1S/C16H22FIN2S/c1-10-6-12(9-16(2,3)8-10)19-15(21)20-14-5-4-11(18)7-13(14)17/h4-5,7,10,12H,6,8-9H2,1-3H3,(H2,19,20,21)/t10-,12+/m1/s1