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

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-(1,3,5-trimethylpyrazol-4-yl)thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-(1,3,5-trimethylpyrazol-4-yl)thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-(1,3,5-trimethylpyrazol-4-yl)thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-(1,3,5-trimethylpyrazol-4-yl)thiourea Formula: C13H14ClFN4S MolecularWeight: 312.793463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=S)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=S)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C13H14ClFN4S/c1-7-12(8(2)19(3)18-7)17-13(20)16-9-4-5-11(15)10(14)6-9/h4-6H,1-3H3,(H2,16,17,20)