N-[2-(1,3-benzothiazol-2-ylamino)-1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl]-4-methyl-benzamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-ylamino)-1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl]-4-methyl-benzamide Openeye Name: N-[1-(1,3-benzothiazol-2-ylamino)-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-4-methyl-benzamide CAS Name: N-[2-(1,3-benzothiazol-2-ylamino)-1,1,1,3,3,3-hexafluoropropan-2-yl]-4-methylbenzamide IUPAC Name: N-[2-(1,3-benzothiazol-2-ylamino)-1,1,1,3,3,3-hexafluoropropan-2-yl]-4-methylbenzamide Traditional Name: N-[1-(1,3-benzothiazol-2-ylamino)-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-4-methyl-benzamide Formula: C18H13F6N3OS MolecularWeight: 433.370739

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(C(F)(F)F)(C(F)(F)F)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(C(F)(F)F)(C(F)(F)F)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H13F6N3OS/c1-10-6-8-11(9-7-10)14(28)26-16(17(19,20)21,18(22,23)24)27-15-25-12-4-2-3-5-13(12)29-15/h2-9H,1H3,(H,25,27)(H,26,28)