N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-4-yl]-4-(phenoxymethyl)thiophene-2-carboxamide

Systemtic Name: N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-4-yl]-4-(phenoxymethyl)thiophene-2-carboxamide Openeye Name: N-[1-[(2-chloro-4-fluoro-phenyl)methyl]pyrazol-4-yl]-4-(phenoxymethyl)thiophene-2-carboxamide CAS Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]-4-pyrazolyl]-4-(phenoxymethyl)-2-thiophenecarboxamide IUPAC Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]pyrazol-4-yl]-4-(phenoxymethyl)thiophene-2-carboxamide Traditional Name: N-[1-(2-chloro-4-fluoro-benzyl)pyrazol-4-yl]-4-(phenoxymethyl)thiophene-2-carboxamide Formula: C22H17ClFN3O2S MolecularWeight: 441.905683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=CSC(=C2)C(=O)NC3=CN(N=C3)CC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)OCC2=CSC(=C2)C(=O)NC3=CN(N=C3)CC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C22H17ClFN3O2S/c23-20-9-17(24)7-6-16(20)11-27-12-18(10-25-27)26-22(28)21-8-15(14-30-21)13-29-19-4-2-1-3-5-19/h1-10,12,14H,11,13H2,(H,26,28)