1-(4-butylphenyl)-3-[2-(3-fluoranylphenoxy)ethanoylamino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[2-(3-fluoranylphenoxy)ethanoylamino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[[2-(3-fluorophenoxy)acetyl]amino]thiourea CAS Name: 1-(4-butylphenyl)-3-[[2-(3-fluorophenoxy)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[[2-(3-fluorophenoxy)acetyl]amino]thiourea Traditional Name: 1-(4-butylphenyl)-3-[[2-(3-fluorophenoxy)acetyl]amino]thiourea Formula: C19H22FN3O2S MolecularWeight: 375.460283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)COC2=CC(=CC=C2)F

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)COC2=CC(=CC=C2)F

InChI

InChI=1S/C19H22FN3O2S/c1-2-3-5-14-8-10-16(11-9-14)21-19(26)23-22-18(24)13-25-17-7-4-6-15(20)12-17/h4,6-12H,2-3,5,13H2,1H3,(H,22,24)(H2,21,23,26)