1-(2-methylprop-2-enyl)-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(2-methylprop-2-enyl)-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(2-methylallyl)-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(2-methylprop-2-enyl)-3-[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(2-methylprop-2-enyl)-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(2-methylallyl)-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Formula: C15H15F3N4S MolecularWeight: 340.36661

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CNC(=S)NC1=C(C=CC(=C1)C(F)(F)F)N2C=CC=N2

Isomeric SMILES

CC(=C)CNC(=S)NC1=C(C=CC(=C1)C(F)(F)F)N2C=CC=N2

InChI

InChI=1S/C15H15F3N4S/c1-10(2)9-19-14(23)21-12-8-11(15(16,17)18)4-5-13(12)22-7-3-6-20-22/h3-8H,1,9H2,2H3,(H2,19,21,23)