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

Systemtic Name: 1-butyl-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-butyl-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea CAS Name: 1-butyl-3-[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-butyl-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-butyl-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Formula: C15H17F3N4S MolecularWeight: 342.38249

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17F3N4S/c1-2-3-7-19-14(23)21-12-10-11(15(16,17)18)5-6-13(12)22-9-4-8-20-22/h4-6,8-10H,2-3,7H2,1H3,(H2,19,21,23)