3-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)-1-pyrazolyl]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)propionamide Formula: C16H14BrF3N4OS MolecularWeight: 447.27277

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCN3C(=C(C(=N3)C(F)(F)F)Br)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCN3C(=C(C(=N3)C(F)(F)F)Br)C

InChI

InChI=1S/C16H14BrF3N4OS/c1-8-3-4-10-11(7-8)26-15(21-10)22-12(25)5-6-24-9(2)13(17)14(23-24)16(18,19)20/h3-4,7H,5-6H2,1-2H3,(H,21,22,25)