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

Systemtic Name: 1-(furan-2-ylmethyl)-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(2-furylmethyl)-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(2-furanylmethyl)-3-[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(furan-2-ylmethyl)-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(2-furfuryl)-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Formula: C16H13F3N4OS MolecularWeight: 366.36083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=S)NCC3=CC=CO3

Isomeric SMILES

C1=CN(N=C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=S)NCC3=CC=CO3

InChI

InChI=1S/C16H13F3N4OS/c17-16(18,19)11-4-5-14(23-7-2-6-21-23)13(9-11)22-15(25)20-10-12-3-1-8-24-12/h1-9H,10H2,(H2,20,22,25)