N-[2-(2-methylpropanoylamino)ethyl]-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[2-(2-methylpropanoylamino)ethyl]-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-[2-(2-methylpropanoylamino)ethyl]-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-[2-(2-methylpropanoylamino)ethyl]-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-[2-(isobutyrylamino)ethyl]-2-(2-thienyl)cinchoninamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CS3

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CS3

InChI

InChI=1S/C20H21N3O2S/c1-13(2)19(24)21-9-10-22-20(25)15-12-17(18-8-5-11-26-18)23-16-7-4-3-6-14(15)16/h3-8,11-13H,9-10H2,1-2H3,(H,21,24)(H,22,25)