N-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]-2-[(6-fluoranyl-1H-benzimidazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]-2-[(6-fluoranyl-1H-benzimidazol-2-yl)sulfanyl]ethanamide Openeye Name: N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-2-[(6-fluoro-1H-benzimidazol-2-yl)sulfanyl]acetamide CAS Name: N-[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]-2-[(6-fluoro-1H-benzimidazol-2-yl)thio]acetamide IUPAC Name: N-(1-benzyl-3,5-dimethylpyrazol-4-yl)-2-[(6-fluoro-1H-benzimidazol-2-yl)sulfanyl]acetamide Traditional Name: N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-2-[(6-fluoro-1H-benzimidazol-2-yl)thio]acetamide Formula: C21H20FN5OS MolecularWeight: 409.479803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)NC(=O)CSC3=NC4=C(N3)C=C(C=C4)F

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)NC(=O)CSC3=NC4=C(N3)C=C(C=C4)F

InChI

InChI=1S/C21H20FN5OS/c1-13-20(14(2)27(26-13)11-15-6-4-3-5-7-15)25-19(28)12-29-21-23-17-9-8-16(22)10-18(17)24-21/h3-10H,11-12H2,1-2H3,(H,23,24)(H,25,28)