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

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-(2,4,4-trimethylpentan-2-yl)thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-(1,1,3,3-tetramethylbutyl)thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-(2,4,4-trimethylpentan-2-yl)thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-(2,4,4-trimethylpentan-2-yl)thiourea Traditional Name: 1-(4-fluorobenzyl)-3-(1,1,3,3-tetramethylbutyl)thiourea Formula: C16H25FN2S MolecularWeight: 296.446503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25FN2S/c1-15(2,3)11-16(4,5)19-14(20)18-10-12-6-8-13(17)9-7-12/h6-9H,10-11H2,1-5H3,(H2,18,19,20)