N-[2-[(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]-1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl]-3-phenyl-propanamide

Systemtic Name: N-[2-[(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]-1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl]-3-phenyl-propanamide Openeye Name: N-[1-[(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-3-phenyl-propanamide CAS Name: N-[2-[(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl]-3-phenylpropanamide IUPAC Name: N-[2-[(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl]-3-phenylpropanamide Traditional Name: N-[1-[(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-3-phenyl-propionamide Formula: C21H19F6N3OS MolecularWeight: 475.450479

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)NC(C(F)(F)F)(C(F)(F)F)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)NC(C(F)(F)F)(C(F)(F)F)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C21H19F6N3OS/c1-12-10-15-16(11-13(12)2)32-18(28-15)30-19(20(22,23)24,21(25,26)27)29-17(31)9-8-14-6-4-3-5-7-14/h3-7,10-11H,8-9H2,1-2H3,(H,28,30)(H,29,31)