N-(1-methylsulfonylpiperidin-4-yl)-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(1-methylsulfonylpiperidin-4-yl)-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-(1-methylsulfonyl-4-piperidyl)-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-(1-methylsulfonyl-4-piperidinyl)-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-(1-methylsulfonylpiperidin-4-yl)-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-(1-mesyl-4-piperidyl)-2-(2-thienyl)cinchoninamide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C20H21N3O3S2/c1-28(25,26)23-10-8-14(9-11-23)21-20(24)16-13-18(19-7-4-12-27-19)22-17-6-3-2-5-15(16)17/h2-7,12-14H,8-11H2,1H3,(H,21,24)