ethyl 1-[2-methyl-5-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]sulfanyl]phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-methyl-5-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]sulfanyl]phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[2-methyl-5-[2-(2-pyridylamino)thiazol-5-yl]sulfanyl-benzoyl]piperidine-4-carboxylate CAS Name: 1-[[2-methyl-5-[[2-(2-pyridinylamino)-5-thiazolyl]thio]phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-methyl-5-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]sulfanyl]benzoyl]piperidine-4-carboxylate Traditional Name: 1-[2-methyl-5-[[2-(2-pyridylamino)thiazol-5-yl]thio]benzoyl]isonipecotic acid ethyl ester Formula: C24H26N4O3S2 MolecularWeight: 482.61824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=C(C=CC(=C2)SC3=CN=C(S3)NC4=CC=CC=N4)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=C(C=CC(=C2)SC3=CN=C(S3)NC4=CC=CC=N4)C

InChI

InChI=1S/C24H26N4O3S2/c1-3-31-23(30)17-9-12-28(13-10-17)22(29)19-14-18(8-7-16(19)2)32-21-15-26-24(33-21)27-20-6-4-5-11-25-20/h4-8,11,14-15,17H,3,9-10,12-13H2,1-2H3,(H,25,26,27)