5-chloranyl-N-[(5-fluoranyl-1-benzothiophen-2-yl)methyl]-3-methyl-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-[(5-fluoranyl-1-benzothiophen-2-yl)methyl]-3-methyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-N-[(5-fluorobenzothiophen-2-yl)methyl]-3-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-[(5-fluoro-1-benzothiophen-2-yl)methyl]-3-methyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-[(5-fluoro-1-benzothiophen-2-yl)methyl]-3-methyl-1-phenylpyrazole-4-carboxamide Traditional Name: 5-chloro-N-[(5-fluorobenzothiophen-2-yl)methyl]-3-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C20H15ClFN3OS MolecularWeight: 399.869003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCC2=CC3=C(S2)C=CC(=C3)F)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCC2=CC3=C(S2)C=CC(=C3)F)Cl)C4=CC=CC=C4

InChI

InChI=1S/C20H15ClFN3OS/c1-12-18(19(21)25(24-12)15-5-3-2-4-6-15)20(26)23-11-16-10-13-9-14(22)7-8-17(13)27-16/h2-10H,11H2,1H3,(H,23,26)