1-[(4-fluorophenyl)methyl]-3-(2-methylbutan-2-yl)thiourea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-(2-methylbutan-2-yl)thiourea Openeye Name: 1-(1,1-dimethylpropyl)-3-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-(2-methylbutan-2-yl)thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-(2-methylbutan-2-yl)thiourea Traditional Name: 1-tert-amyl-3-(4-fluorobenzyl)thiourea Formula: C13H19FN2S MolecularWeight: 254.366763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=S)NCC1=CC=C(C=C1)F

Isomeric SMILES

CCC(C)(C)NC(=S)NCC1=CC=C(C=C1)F

InChI

InChI=1S/C13H19FN2S/c1-4-13(2,3)16-12(17)15-9-10-5-7-11(14)8-6-10/h5-8H,4,9H2,1-3H3,(H2,15,16,17)