1-(4-chloranyl-3-fluoranyl-phenyl)-3-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]thiourea

Systemtic Name: 1-(4-chloranyl-3-fluoranyl-phenyl)-3-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]thiourea Openeye Name: 1-(4-chloro-3-fluoro-phenyl)-3-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]thiourea CAS Name: 1-(4-chloro-3-fluorophenyl)-3-[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]thiourea IUPAC Name: 1-(4-chloro-3-fluorophenyl)-3-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]thiourea Traditional Name: 1-(4-chloro-3-fluoro-phenyl)-3-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]thiourea Formula: C22H15Cl2FN4S MolecularWeight: 457.350703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Cl)NC(=S)NC4=CC(=C(C=C4)Cl)F

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Cl)NC(=S)NC4=CC(=C(C=C4)Cl)F

InChI

InChI=1S/C22H15Cl2FN4S/c23-15-8-6-14(7-9-15)21-20(13-29(28-21)17-4-2-1-3-5-17)27-22(30)26-16-10-11-18(24)19(25)12-16/h1-13H,(H2,26,27,30)