1-[(4-methoxyphenyl)methyl]-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[(4-methoxyphenyl)methyl]-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[(4-methoxyphenyl)methyl]-3-[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[(4-methoxyphenyl)methyl]-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-p-anisyl-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Formula: C19H17F3N4OS MolecularWeight: 406.42469

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)NC2=C(C=CC(=C2)C(F)(F)F)N3C=CC=N3

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)NC2=C(C=CC(=C2)C(F)(F)F)N3C=CC=N3

InChI

InChI=1S/C19H17F3N4OS/c1-27-15-6-3-13(4-7-15)12-23-18(28)25-16-11-14(19(20,21)22)5-8-17(16)26-10-2-9-24-26/h2-11H,12H2,1H3,(H2,23,25,28)