1-(4-butylphenyl)-3-[3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]thiourea Openeye Name: 1-(4-butylphenyl)-3-[3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]thiourea CAS Name: 1-(4-butylphenyl)-3-[3-[5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]propyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]thiourea Traditional Name: 1-(4-butylphenyl)-3-[3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]thiourea Formula: C21H27F3N4S MolecularWeight: 424.52609

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NCCCN2C(=CC(=N2)C(F)(F)F)C3CC3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NCCCN2C(=CC(=N2)C(F)(F)F)C3CC3

InChI

InChI=1S/C21H27F3N4S/c1-2-3-5-15-6-10-17(11-7-15)26-20(29)25-12-4-13-28-18(16-8-9-16)14-19(27-28)21(22,23)24/h6-7,10-11,14,16H,2-5,8-9,12-13H2,1H3,(H2,25,26,29)