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

Systemtic Name: 1-propyl-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-propyl-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea CAS Name: 1-propyl-3-[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-propyl-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-propyl-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Formula: C14H15F3N4S MolecularWeight: 328.35591

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15F3N4S/c1-2-6-18-13(22)20-11-9-10(14(15,16)17)4-5-12(11)21-8-3-7-19-21/h3-5,7-9H,2,6H2,1H3,(H2,18,20,22)