[1-oxidanylidene-1-(quinolin-5-ylamino)propan-2-yl] 1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxylate

Systemtic Name: [1-oxidanylidene-1-(quinolin-5-ylamino)propan-2-yl] 1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxylate Openeye Name: [1-methyl-2-oxo-2-(5-quinolylamino)ethyl] 1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carboxylate CAS Name: 1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinecarboxylic acid [1-oxo-1-(5-quinolinylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(quinolin-5-ylamino)propan-2-yl] 1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxylate Traditional Name: 1-[(5-methyl-2-thienyl)sulfonyl]nipecotic acid [2-keto-1-methyl-2-(5-quinolylamino)ethyl] ester Formula: C23H25N3O5S2 MolecularWeight: 487.5917

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)OC(C)C(=O)NC3=CC=CC4=C3C=CC=N4

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)OC(C)C(=O)NC3=CC=CC4=C3C=CC=N4

InChI

InChI=1S/C23H25N3O5S2/c1-15-10-11-21(32-15)33(29,30)26-13-5-6-17(14-26)23(28)31-16(2)22(27)25-20-9-3-8-19-18(20)7-4-12-24-19/h3-4,7-12,16-17H,5-6,13-14H2,1-2H3,(H,25,27)