tert-butyl N-[4-phenyl-2-(sulfanylmethyl)-5-(trifluoromethyl)thiophen-3-yl]carbamate

Systemtic Name: tert-butyl N-[4-phenyl-2-(sulfanylmethyl)-5-(trifluoromethyl)thiophen-3-yl]carbamate Openeye Name: tert-butyl N-[4-phenyl-2-(sulfanylmethyl)-5-(trifluoromethyl)-3-thienyl]carbamate CAS Name: N-[2-(mercaptomethyl)-4-phenyl-5-(trifluoromethyl)-3-thiophenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-phenyl-2-(sulfanylmethyl)-5-(trifluoromethyl)thiophen-3-yl]carbamate Traditional Name: N-[2-(mercaptomethyl)-4-phenyl-5-(trifluoromethyl)-3-thienyl]carbamic acid tert-butyl ester Formula: C17H18F3NO2S2 MolecularWeight: 389.45553

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(SC(=C1C2=CC=CC=C2)C(F)(F)F)CS

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(SC(=C1C2=CC=CC=C2)C(F)(F)F)CS

InChI

InChI=1S/C17H18F3NO2S2/c1-16(2,3)23-15(22)21-13-11(9-24)25-14(17(18,19)20)12(13)10-7-5-4-6-8-10/h4-8,24H,9H2,1-3H3,(H,21,22)