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

Systemtic Name: 1-(3-ethylphenyl)-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(3-ethylphenyl)-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(3-ethylphenyl)-3-[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(3-ethylphenyl)-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(3-ethylphenyl)-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Formula: C19H17F3N4S MolecularWeight: 390.42529

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)N3C=CC=N3

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)N3C=CC=N3

InChI

InChI=1S/C19H17F3N4S/c1-2-13-5-3-6-15(11-13)24-18(27)25-16-12-14(19(20,21)22)7-8-17(16)26-10-4-9-23-26/h3-12H,2H2,1H3,(H2,24,25,27)