1-(2-ethyl-6-methyl-phenyl)-3-[2-(4-fluorophenyl)sulfanylethanoylamino]thiourea

Systemtic Name: 1-(2-ethyl-6-methyl-phenyl)-3-[2-(4-fluorophenyl)sulfanylethanoylamino]thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[2-(4-fluorophenyl)sulfanylacetyl]amino]thiourea CAS Name: 1-(2-ethyl-6-methylphenyl)-3-[[2-[(4-fluorophenyl)thio]-1-oxoethyl]amino]thiourea IUPAC Name: 1-(2-ethyl-6-methylphenyl)-3-[[2-(4-fluorophenyl)sulfanylacetyl]amino]thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[2-[(4-fluorophenyl)thio]acetyl]amino]thiourea Formula: C18H20FN3OS2 MolecularWeight: 377.499303

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)CSC2=CC=C(C=C2)F)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)CSC2=CC=C(C=C2)F)C

InChI

InChI=1S/C18H20FN3OS2/c1-3-13-6-4-5-12(2)17(13)20-18(24)22-21-16(23)11-25-15-9-7-14(19)8-10-15/h4-10H,3,11H2,1-2H3,(H,21,23)(H2,20,22,24)