2-(4-chloranyl-6-piperidin-1-yl-pyrimidin-2-yl)sulfanyl-N-(pyridin-2-ylmethyl)ethanamide

Systemtic Name: 2-(4-chloranyl-6-piperidin-1-yl-pyrimidin-2-yl)sulfanyl-N-(pyridin-2-ylmethyl)ethanamide Openeye Name: 2-[4-chloro-6-(1-piperidyl)pyrimidin-2-yl]sulfanyl-N-(2-pyridylmethyl)acetamide CAS Name: 2-[[4-chloro-6-(1-piperidinyl)-2-pyrimidinyl]thio]-N-(2-pyridinylmethyl)acetamide IUPAC Name: 2-(4-chloro-6-piperidin-1-ylpyrimidin-2-yl)sulfanyl-N-(pyridin-2-ylmethyl)acetamide Traditional Name: 2-[(4-chloro-6-piperidino-pyrimidin-2-yl)thio]-N-(2-pyridylmethyl)acetamide Formula: C17H20ClN5OS MolecularWeight: 377.8916

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=NC(=N2)SCC(=O)NCC3=CC=CC=N3)Cl

Isomeric SMILES

C1CCN(CC1)C2=CC(=NC(=N2)SCC(=O)NCC3=CC=CC=N3)Cl

InChI

InChI=1S/C17H20ClN5OS/c18-14-10-15(23-8-4-1-5-9-23)22-17(21-14)25-12-16(24)20-11-13-6-2-3-7-19-13/h2-3,6-7,10H,1,4-5,8-9,11-12H2,(H,20,24)