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

Systemtic Name: 2-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(6-mesyl-1,3-benzothiazol-2-yl)propionamide Formula: C18H16BrF3N4O3S2 MolecularWeight: 537.37385

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)N3C(=C(C(=N3)C(F)(F)F)Br)C4CC4

Isomeric SMILES

CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)N3C(=C(C(=N3)C(F)(F)F)Br)C4CC4

InChI

InChI=1S/C18H16BrF3N4O3S2/c1-8(26-14(9-3-4-9)13(19)15(25-26)18(20,21)22)16(27)24-17-23-11-6-5-10(31(2,28)29)7-12(11)30-17/h5-9H,3-4H2,1-2H3,(H,23,24,27)