N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-ethyl]-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-[2-(tert-butylamino)-2-oxoethyl]-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-[2-(tert-butylamino)-2-keto-ethyl]-2-(2-thienyl)cinchoninamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CS3

Isomeric SMILES

CC(C)(C)NC(=O)CNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CS3

InChI

InChI=1S/C20H21N3O2S/c1-20(2,3)23-18(24)12-21-19(25)14-11-16(17-9-6-10-26-17)22-15-8-5-4-7-13(14)15/h4-11H,12H2,1-3H3,(H,21,25)(H,23,24)