1-(3-chloranyl-4-fluoranyl-phenyl)-3-(2-phenyl-3,4-dihydropyrazol-5-yl)thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-(2-phenyl-3,4-dihydropyrazol-5-yl)thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-(2-phenyl-3,4-dihydropyrazol-5-yl)thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-(2-phenyl-3,4-dihydropyrazol-5-yl)thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-(2-phenyl-3,4-dihydropyrazol-5-yl)thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-(1-phenyl-2-pyrazolin-3-yl)thiourea Formula: C16H14ClFN4S MolecularWeight: 348.825563

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1NC(=S)NC2=CC(=C(C=C2)F)Cl)C3=CC=CC=C3

Isomeric SMILES

C1CN(N=C1NC(=S)NC2=CC(=C(C=C2)F)Cl)C3=CC=CC=C3

InChI

InChI=1S/C16H14ClFN4S/c17-13-10-11(6-7-14(13)18)19-16(23)20-15-8-9-22(21-15)12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H2,19,20,21,23)