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

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]thiourea Formula: C19H18ClFN4S MolecularWeight: 388.889423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=S)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=S)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C19H18ClFN4S/c1-12-16(13(2)25(24-12)15-6-4-3-5-7-15)11-22-19(26)23-14-8-9-18(21)17(20)10-14/h3-10H,11H2,1-2H3,(H2,22,23,26)