N-(3-methylsulfonylphenyl)-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(3-methylsulfonylphenyl)-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-(3-methylsulfonylphenyl)-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-(3-methylsulfonylphenyl)-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-(3-methylsulfonylphenyl)-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-(3-mesylphenyl)-2-(2-thienyl)cinchoninamide Formula: C21H16N2O3S2 MolecularWeight: 408.49334

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C21H16N2O3S2/c1-28(25,26)15-7-4-6-14(12-15)22-21(24)17-13-19(20-10-5-11-27-20)23-18-9-3-2-8-16(17)18/h2-13H,1H3,(H,22,24)