1-(3-chloranyl-4-fluoranyl-phenyl)-3-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[(1-ethyl-3,5-dimethyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]thiourea Formula: C15H18ClFN4S MolecularWeight: 340.846623

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)CNC(=S)NC2=CC(=C(C=C2)F)Cl)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)CNC(=S)NC2=CC(=C(C=C2)F)Cl)C

InChI

InChI=1S/C15H18ClFN4S/c1-4-21-10(3)12(9(2)20-21)8-18-15(22)19-11-5-6-14(17)13(16)7-11/h5-7H,4,8H2,1-3H3,(H2,18,19,22)