ethyl (2R)-1-(2-quinazolin-4-ylsulfanylethanoyl)piperidine-2-carboxylate

Systemtic Name: ethyl (2R)-1-(2-quinazolin-4-ylsulfanylethanoyl)piperidine-2-carboxylate Openeye Name: ethyl (2R)-1-(2-quinazolin-4-ylsulfanylacetyl)piperidine-2-carboxylate CAS Name: (2R)-1-[1-oxo-2-(4-quinazolinylthio)ethyl]-2-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2R)-1-(2-quinazolin-4-ylsulfanylacetyl)piperidine-2-carboxylate Traditional Name: (2R)-1-[2-(quinazolin-4-ylthio)acetyl]pipecolinic acid ethyl ester Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCN1C(=O)CSC2=NC=NC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)[C@H]1CCCCN1C(=O)CSC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C18H21N3O3S/c1-2-24-18(23)15-9-5-6-10-21(15)16(22)11-25-17-13-7-3-4-8-14(13)19-12-20-17/h3-4,7-8,12,15H,2,5-6,9-11H2,1H3/t15-/m1/s1