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

Systemtic Name: N-methyl-N-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-methyl-N-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-methyl-N-[2-[2-(methylthio)anilino]-2-oxoethyl]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-methyl-N-[2-(2-methylsulfanylanilino)-2-oxoethyl]-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-[2-keto-2-[2-(methylthio)anilino]ethyl]-N-methyl-2-(2-thienyl)cinchoninamide Formula: C24H21N3O2S2 MolecularWeight: 447.57244

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1SC)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1SC)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C24H21N3O2S2/c1-27(15-23(28)26-19-10-5-6-11-21(19)30-2)24(29)17-14-20(22-12-7-13-31-22)25-18-9-4-3-8-16(17)18/h3-14H,15H2,1-2H3,(H,26,28)