1-ethyl-3-[3-(4-fluorophenyl)sulfanylpropanoylamino]thiourea

Systemtic Name: 1-ethyl-3-[3-(4-fluorophenyl)sulfanylpropanoylamino]thiourea Openeye Name: 1-ethyl-3-[3-(4-fluorophenyl)sulfanylpropanoylamino]thiourea CAS Name: 1-ethyl-3-[[3-[(4-fluorophenyl)thio]-1-oxopropyl]amino]thiourea IUPAC Name: 1-ethyl-3-[3-(4-fluorophenyl)sulfanylpropanoylamino]thiourea Traditional Name: 1-ethyl-3-[3-[(4-fluorophenyl)thio]propanoylamino]thiourea Formula: C12H16FN3OS2 MolecularWeight: 301.403343

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC(=O)CCSC1=CC=C(C=C1)F

Isomeric SMILES

CCNC(=S)NNC(=O)CCSC1=CC=C(C=C1)F

InChI

InChI=1S/C12H16FN3OS2/c1-2-14-12(18)16-15-11(17)7-8-19-10-5-3-9(13)4-6-10/h3-6H,2,7-8H2,1H3,(H,15,17)(H2,14,16,18)