6-(4-methylpiperidin-1-yl)sulfonyl-N-(phenylmethyl)-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: 6-(4-methylpiperidin-1-yl)sulfonyl-N-(phenylmethyl)-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-benzyl-6-[(4-methyl-1-piperidyl)sulfonyl]-2-(2-thienyl)quinoline-4-carboxamide CAS Name: 6-[(4-methyl-1-piperidinyl)sulfonyl]-N-(phenylmethyl)-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-benzyl-6-(4-methylpiperidin-1-yl)sulfonyl-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-benzyl-6-(4-methylpiperidino)sulfonyl-2-(2-thienyl)cinchoninamide Formula: C27H27N3O3S2 MolecularWeight: 505.65158

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C(=O)NCC4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C(=O)NCC4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C27H27N3O3S2/c1-19-11-13-30(14-12-19)35(32,33)21-9-10-24-22(16-21)23(17-25(29-24)26-8-5-15-34-26)27(31)28-18-20-6-3-2-4-7-20/h2-10,15-17,19H,11-14,18H2,1H3,(H,28,31)