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

Systemtic Name: 1-(4-butylphenyl)-3-[3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]thiourea Openeye Name: 1-(4-butylphenyl)-3-[3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]thiourea CAS Name: 1-(4-butylphenyl)-3-[3-[5-methyl-3-(trifluoromethyl)-1-pyrazolyl]propyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]thiourea Traditional Name: 1-(4-butylphenyl)-3-[3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]thiourea Formula: C19H25F3N4S MolecularWeight: 398.48881

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25F3N4S/c1-3-4-6-15-7-9-16(10-8-15)24-18(27)23-11-5-12-26-14(2)13-17(25-26)19(20,21)22/h7-10,13H,3-6,11-12H2,1-2H3,(H2,23,24,27)