N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(p-tolyl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(p-tolyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C21H17F3N4OS MolecularWeight: 430.44609

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NC3=NC4=C(C=C(C=C4S3)C)C)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NC3=NC4=C(C=C(C=C4S3)C)C)C(F)(F)F

InChI

InChI=1S/C21H17F3N4OS/c1-11-4-6-14(7-5-11)28-18(21(22,23)24)15(10-25-28)19(29)27-20-26-17-13(3)8-12(2)9-16(17)30-20/h4-10H,1-3H3,(H,26,27,29)