N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-4-yl]-4-(phenoxymethyl)thiophene-2-carboxamide

Systemtic Name: N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-4-yl]-4-(phenoxymethyl)thiophene-2-carboxamide Openeye Name: N-[1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-4-yl]-4-(phenoxymethyl)thiophene-2-carboxamide CAS Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]-4-pyrazolyl]-4-(phenoxymethyl)-2-thiophenecarboxamide IUPAC Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-4-yl]-4-(phenoxymethyl)thiophene-2-carboxamide Traditional Name: N-[1-(2-chloro-6-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=CC=C4Cl)F

Isomeric SMILES

C1=CC=C(C=C1)OCC2=CSC(=C2)C(=O)NC3=CN(N=C3)CC4=C(C=CC=C4Cl)F

InChI

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