1-(3-ethanoylphenyl)-3-[1-[(2-fluorophenyl)methyl]pyrazol-4-yl]thiourea

Systemtic Name: 1-(3-ethanoylphenyl)-3-[1-[(2-fluorophenyl)methyl]pyrazol-4-yl]thiourea Openeye Name: 1-(3-acetylphenyl)-3-[1-[(2-fluorophenyl)methyl]pyrazol-4-yl]thiourea CAS Name: 1-(3-acetylphenyl)-3-[1-[(2-fluorophenyl)methyl]-4-pyrazolyl]thiourea IUPAC Name: 1-(3-acetylphenyl)-3-[1-[(2-fluorophenyl)methyl]pyrazol-4-yl]thiourea Traditional Name: 1-(3-acetylphenyl)-3-[1-(2-fluorobenzyl)pyrazol-4-yl]thiourea Formula: C19H17FN4OS MolecularWeight: 368.427883

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=S)NC2=CN(N=C2)CC3=CC=CC=C3F

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=S)NC2=CN(N=C2)CC3=CC=CC=C3F

InChI

InChI=1S/C19H17FN4OS/c1-13(25)14-6-4-7-16(9-14)22-19(26)23-17-10-21-24(12-17)11-15-5-2-3-8-18(15)20/h2-10,12H,11H2,1H3,(H2,22,23,26)