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

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[(1,3,5-trimethyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea Formula: C14H16ClFN4S MolecularWeight: 326.820043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16ClFN4S/c1-8-11(9(2)20(3)19-8)7-17-14(21)18-10-4-5-13(16)12(15)6-10/h4-6H,7H2,1-3H3,(H2,17,18,21)