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

Systemtic Name: 1-[[2,5-bis(fluoranyl)phenyl]methyl]-3-(4-butylphenyl)thiourea Openeye Name: 1-(4-butylphenyl)-3-[(2,5-difluorophenyl)methyl]thiourea CAS Name: 1-(4-butylphenyl)-3-[(2,5-difluorophenyl)methyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[(2,5-difluorophenyl)methyl]thiourea Traditional Name: 1-(4-butylphenyl)-3-(2,5-difluorobenzyl)thiourea Formula: C18H20F2N2S MolecularWeight: 334.426606

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20F2N2S/c1-2-3-4-13-5-8-16(9-6-13)22-18(23)21-12-14-11-15(19)7-10-17(14)20/h5-11H,2-4,12H2,1H3,(H2,21,22,23)