N-(8-methylquinolin-5-yl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(8-methylquinolin-5-yl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-(8-methyl-5-quinolyl)-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-(8-methyl-5-quinolinyl)-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-(8-methylquinolin-5-yl)-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-(8-methyl-5-quinolyl)-1-(2-thienylsulfonyl)nipecotamide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CS4)C=CC=N2

Isomeric SMILES

CC1=C2C(=C(C=C1)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CS4)C=CC=N2

InChI

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