ethyl 1-(2-imidazo[1,5-a]pyridin-3-ylsulfanylethanoyl)piperidine-3-carboxylate

Systemtic Name: ethyl 1-(2-imidazo[1,5-a]pyridin-3-ylsulfanylethanoyl)piperidine-3-carboxylate Openeye Name: ethyl 1-(2-imidazo[1,5-a]pyridin-3-ylsulfanylacetyl)piperidine-3-carboxylate CAS Name: 1-[2-(3-imidazo[1,5-a]pyridinylthio)-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-imidazo[1,5-a]pyridin-3-ylsulfanylacetyl)piperidine-3-carboxylate Traditional Name: 1-[2-(imidazo[1,5-a]pyridin-3-ylthio)acetyl]nipecotic acid ethyl ester Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CSC2=NC=C3N2C=CC=C3

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CSC2=NC=C3N2C=CC=C3

InChI

InChI=1S/C17H21N3O3S/c1-2-23-16(22)13-6-5-8-19(11-13)15(21)12-24-17-18-10-14-7-3-4-9-20(14)17/h3-4,7,9-10,13H,2,5-6,8,11-12H2,1H3