2-(4-chloranyl-6-piperidin-1-yl-pyrimidin-2-yl)sulfanyl-N-(3,3-diphenylpropyl)ethanamide

Systemtic Name: 2-(4-chloranyl-6-piperidin-1-yl-pyrimidin-2-yl)sulfanyl-N-(3,3-diphenylpropyl)ethanamide Openeye Name: 2-[4-chloro-6-(1-piperidyl)pyrimidin-2-yl]sulfanyl-N-(3,3-diphenylpropyl)acetamide CAS Name: 2-[[4-chloro-6-(1-piperidinyl)-2-pyrimidinyl]thio]-N-(3,3-diphenylpropyl)acetamide IUPAC Name: 2-(4-chloro-6-piperidin-1-ylpyrimidin-2-yl)sulfanyl-N-(3,3-diphenylpropyl)acetamide Traditional Name: 2-[(4-chloro-6-piperidino-pyrimidin-2-yl)thio]-N-(3,3-diphenylpropyl)acetamide Formula: C26H29ClN4OS MolecularWeight: 481.05266

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=NC(=N2)SCC(=O)NCCC(C3=CC=CC=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

C1CCN(CC1)C2=CC(=NC(=N2)SCC(=O)NCCC(C3=CC=CC=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C26H29ClN4OS/c27-23-18-24(31-16-8-3-9-17-31)30-26(29-23)33-19-25(32)28-15-14-22(20-10-4-1-5-11-20)21-12-6-2-7-13-21/h1-2,4-7,10-13,18,22H,3,8-9,14-17,19H2,(H,28,32)