1-[[2,5-bis(fluoranyl)phenyl]methyl]-3-(4-butyl-2-methyl-phenyl)thiourea

Systemtic Name: 1-[[2,5-bis(fluoranyl)phenyl]methyl]-3-(4-butyl-2-methyl-phenyl)thiourea Openeye Name: 1-(4-butyl-2-methyl-phenyl)-3-[(2,5-difluorophenyl)methyl]thiourea CAS Name: 1-(4-butyl-2-methylphenyl)-3-[(2,5-difluorophenyl)methyl]thiourea IUPAC Name: 1-(4-butyl-2-methylphenyl)-3-[(2,5-difluorophenyl)methyl]thiourea Traditional Name: 1-(4-butyl-2-methyl-phenyl)-3-(2,5-difluorobenzyl)thiourea Formula: C19H22F2N2S MolecularWeight: 348.453186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)NC(=S)NCC2=C(C=CC(=C2)F)F)C

Isomeric SMILES

CCCCC1=CC(=C(C=C1)NC(=S)NCC2=C(C=CC(=C2)F)F)C

InChI

InChI=1S/C19H22F2N2S/c1-3-4-5-14-6-9-18(13(2)10-14)23-19(24)22-12-15-11-16(20)7-8-17(15)21/h6-11H,3-5,12H2,1-2H3,(H2,22,23,24)