1-[[2,4-bis(fluoranyl)phenyl]carbamothioylamino]-3-(4-butylphenyl)urea

Systemtic Name: 1-[[2,4-bis(fluoranyl)phenyl]carbamothioylamino]-3-(4-butylphenyl)urea Openeye Name: 1-(4-butylphenyl)-3-[(2,4-difluorophenyl)carbamothioylamino]urea CAS Name: 1-(4-butylphenyl)-3-[[(2,4-difluoroanilino)-sulfanylidenemethyl]amino]urea IUPAC Name: 1-(4-butylphenyl)-3-[(2,4-difluorophenyl)carbamothioylamino]urea Traditional Name: 1-(4-butylphenyl)-3-[(2,4-difluorophenyl)thiocarbamoylamino]urea Formula: C18H20F2N4OS MolecularWeight: 378.439406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)NNC(=S)NC2=C(C=C(C=C2)F)F

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)NNC(=S)NC2=C(C=C(C=C2)F)F

InChI

InChI=1S/C18H20F2N4OS/c1-2-3-4-12-5-8-14(9-6-12)21-17(25)23-24-18(26)22-16-10-7-13(19)11-15(16)20/h5-11H,2-4H2,1H3,(H2,21,23,25)(H2,22,24,26)