1-(2-ethyl-6-methyl-phenyl)-3-[2-[3-(trifluoromethyl)pyrazol-1-yl]ethanoylamino]thiourea

Systemtic Name: 1-(2-ethyl-6-methyl-phenyl)-3-[2-[3-(trifluoromethyl)pyrazol-1-yl]ethanoylamino]thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[2-[3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]thiourea CAS Name: 1-(2-ethyl-6-methylphenyl)-3-[[1-oxo-2-[3-(trifluoromethyl)-1-pyrazolyl]ethyl]amino]thiourea IUPAC Name: 1-(2-ethyl-6-methylphenyl)-3-[[2-[3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[2-[3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]thiourea Formula: C16H18F3N5OS MolecularWeight: 385.40723

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)CN2C=CC(=N2)C(F)(F)F)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)CN2C=CC(=N2)C(F)(F)F)C

InChI

InChI=1S/C16H18F3N5OS/c1-3-11-6-4-5-10(2)14(11)20-15(26)22-21-13(25)9-24-8-7-12(23-24)16(17,18)19/h4-8H,3,9H2,1-2H3,(H,21,25)(H2,20,22,26)