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

Systemtic Name: 1-[2-(4-fluoranylphenoxy)ethanoylamino]-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-[[2-(4-fluorophenoxy)acetyl]amino]-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-[[2-(4-fluorophenoxy)-1-oxoethyl]amino]-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-[[2-(4-fluorophenoxy)acetyl]amino]-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-[[2-(4-fluorophenoxy)acetyl]amino]-3-[3-(methylthio)propyl]thiourea Formula: C13H18FN3O2S2 MolecularWeight: 331.429323

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=S)NNC(=O)COC1=CC=C(C=C1)F

Isomeric SMILES

CSCCCNC(=S)NNC(=O)COC1=CC=C(C=C1)F

InChI

InChI=1S/C13H18FN3O2S2/c1-21-8-2-7-15-13(20)17-16-12(18)9-19-11-5-3-10(14)4-6-11/h3-6H,2,7-9H2,1H3,(H,16,18)(H2,15,17,20)