ethyl 6-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]pyridine-3-carboxylate

Systemtic Name: ethyl 6-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]pyridine-3-carboxylate Openeye Name: ethyl 6-[3-(1,3-benzothiazol-2-yl)-1-piperidyl]pyridine-3-carboxylate CAS Name: 6-[3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]pyridine-3-carboxylate Traditional Name: 6-[3-(1,3-benzothiazol-2-yl)piperidino]nicotinic acid ethyl ester Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C=C1)N2CCCC(C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC(=O)C1=CN=C(C=C1)N2CCCC(C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H21N3O2S/c1-2-25-20(24)14-9-10-18(21-12-14)23-11-5-6-15(13-23)19-22-16-7-3-4-8-17(16)26-19/h3-4,7-10,12,15H,2,5-6,11,13H2,1H3