N-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-N-[(2-phenylpyrazol-3-yl)methyl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-N-[(2-phenylpyrazol-3-yl)methyl]-1,3-benzothiazole-6-carboxamide Openeye Name: N-[(2-chloro-4-fluoro-phenyl)methyl]-N-[(2-phenylpyrazol-3-yl)methyl]-1,3-benzothiazole-6-carboxamide CAS Name: N-[(2-chloro-4-fluorophenyl)methyl]-N-[(2-phenyl-3-pyrazolyl)methyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[(2-chloro-4-fluorophenyl)methyl]-N-[(2-phenylpyrazol-3-yl)methyl]-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2-chloro-4-fluoro-benzyl)-N-[(2-phenylpyrazol-3-yl)methyl]-1,3-benzothiazole-6-carboxamide Formula: C25H18ClFN4OS MolecularWeight: 476.953023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=CC=N2)CN(CC3=C(C=C(C=C3)F)Cl)C(=O)C4=CC5=C(C=C4)N=CS5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=CC=N2)CN(CC3=C(C=C(C=C3)F)Cl)C(=O)C4=CC5=C(C=C4)N=CS5

InChI

InChI=1S/C25H18ClFN4OS/c26-22-13-19(27)8-6-18(22)14-30(25(32)17-7-9-23-24(12-17)33-16-28-23)15-21-10-11-29-31(21)20-4-2-1-3-5-20/h1-13,16H,14-15H2