N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-[2-(2,6-dimethylanilino)-2-oxo-ethyl]-N-methyl-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-methyl-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-methyl-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-[2-(2,6-dimethylanilino)-2-keto-ethyl]-N-methyl-2-(2-thienyl)cinchoninamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN(C)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN(C)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C25H23N3O2S/c1-16-8-6-9-17(2)24(16)27-23(29)15-28(3)25(30)19-14-21(22-12-7-13-31-22)26-20-11-5-4-10-18(19)20/h4-14H,15H2,1-3H3,(H,27,29)