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

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-pentan-3-yl-thiourea Openeye Name: 1-(1-ethylpropyl)-3-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-pentan-3-ylthiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-pentan-3-ylthiourea Traditional Name: 1-(1-ethylpropyl)-3-(4-fluorobenzyl)thiourea Formula: C13H19FN2S MolecularWeight: 254.366763

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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