N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-4-yl]-3-methyl-thiophene-2-carboxamide

Systemtic Name: N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-4-yl]-3-methyl-thiophene-2-carboxamide Openeye Name: N-[1-[(2-chloro-4-fluoro-phenyl)methyl]pyrazol-4-yl]-3-methyl-thiophene-2-carboxamide CAS Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]-4-pyrazolyl]-3-methyl-2-thiophenecarboxamide IUPAC Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]pyrazol-4-yl]-3-methylthiophene-2-carboxamide Traditional Name: N-[1-(2-chloro-4-fluoro-benzyl)pyrazol-4-yl]-3-methyl-thiophene-2-carboxamide Formula: C16H13ClFN3OS MolecularWeight: 349.810323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)NC2=CN(N=C2)CC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CC1=C(SC=C1)C(=O)NC2=CN(N=C2)CC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C16H13ClFN3OS/c1-10-4-5-23-15(10)16(22)20-13-7-19-21(9-13)8-11-2-3-12(18)6-14(11)17/h2-7,9H,8H2,1H3,(H,20,22)