5-chloranyl-N-(6-fluoranyl-1,3-benzothiazol-2-yl)-3-methyl-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-(6-fluoranyl-1,3-benzothiazol-2-yl)-3-methyl-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-5-chloro-N-(6-fluoro-1,3-benzothiazol-2-yl)-3-methyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-(6-fluoro-1,3-benzothiazol-2-yl)-3-methyl-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-chloro-N-(6-fluoro-1,3-benzothiazol-2-yl)-3-methylpyrazole-4-carboxamide Traditional Name: 1-benzyl-5-chloro-N-(6-fluoro-1,3-benzothiazol-2-yl)-3-methyl-pyrazole-4-carboxamide Formula: C19H14ClFN4OS MolecularWeight: 400.857063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)F)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)F)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C19H14ClFN4OS/c1-11-16(17(20)25(24-11)10-12-5-3-2-4-6-12)18(26)23-19-22-14-8-7-13(21)9-15(14)27-19/h2-9H,10H2,1H3,(H,22,23,26)