N-(2-dimethylaminoethyl)-2-thiophen-2-yl-quinoline-4-carboxamide; ethanedioic acid

Systemtic Name: N-(2-dimethylaminoethyl)-2-thiophen-2-yl-quinoline-4-carboxamide; ethanedioic acid Openeye Name: N-(2-dimethylaminoethyl)-2-(2-thienyl)quinoline-4-carboxamide; oxalic acid CAS Name: N-(2-dimethylaminoethyl)-2-thiophen-2-yl-4-quinolinecarboxamide; oxalic acid IUPAC Name: N-(2-dimethylaminoethyl)-2-thiophen-2-ylquinoline-4-carboxamide; oxalic acid Traditional Name: N-(2-dimethylaminoethyl)-2-(2-thienyl)cinchoninamide; oxalic acid Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CS3.C(=O)(C(=O)O)O

Isomeric SMILES

CN(C)CCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CS3.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H19N3OS.C2H2O4/c1-21(2)10-9-19-18(22)14-12-16(17-8-5-11-23-17)20-15-7-4-3-6-13(14)15;3-1(4)2(5)6/h3-8,11-12H,9-10H2,1-2H3,(H,19,22);(H,3,4)(H,5,6)