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

Systemtic Name: 3-butan-2-yl-1-cyclopentyl-1-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-cyclopentyl-1-[(4-fluorophenyl)methyl]-3-sec-butyl-thiourea CAS Name: 3-butan-2-yl-1-cyclopentyl-1-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 3-butan-2-yl-1-cyclopentyl-1-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-cyclopentyl-1-(4-fluorobenzyl)-3-sec-butyl-thiourea Formula: C17H25FN2S MolecularWeight: 308.457203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=S)N(CC1=CC=C(C=C1)F)C2CCCC2

Isomeric SMILES

CCC(C)NC(=S)N(CC1=CC=C(C=C1)F)C2CCCC2

InChI

InChI=1S/C17H25FN2S/c1-3-13(2)19-17(21)20(16-6-4-5-7-16)12-14-8-10-15(18)11-9-14/h8-11,13,16H,3-7,12H2,1-2H3,(H,19,21)