N-(2-cyanoethyl)-N-methyl-2-thiophen-3-yl-quinoline-4-carboxamide

Systemtic Name: N-(2-cyanoethyl)-N-methyl-2-thiophen-3-yl-quinoline-4-carboxamide Openeye Name: N-(2-cyanoethyl)-N-methyl-2-(3-thienyl)quinoline-4-carboxamide CAS Name: N-(2-cyanoethyl)-N-methyl-2-(3-thiophenyl)-4-quinolinecarboxamide IUPAC Name: N-(2-cyanoethyl)-N-methyl-2-thiophen-3-ylquinoline-4-carboxamide Traditional Name: N-(2-cyanoethyl)-N-methyl-2-(3-thienyl)cinchoninamide Formula: C18H15N3OS MolecularWeight: 321.3962

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)C1=CC(=NC2=CC=CC=C21)C3=CSC=C3

Isomeric SMILES

CN(CCC#N)C(=O)C1=CC(=NC2=CC=CC=C21)C3=CSC=C3

InChI

InChI=1S/C18H15N3OS/c1-21(9-4-8-19)18(22)15-11-17(13-7-10-23-12-13)20-16-6-3-2-5-14(15)16/h2-3,5-7,10-12H,4,9H2,1H3