N-[1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-2-methylsulfanyl-ethanamide

Systemtic Name: N-[1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-2-methylsulfanyl-ethanamide Openeye Name: N-[1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-2-methylsulfanyl-acetamide CAS Name: N-[1-[2-(1-azocanyl)-4-methyl-5-pyrimidinyl]ethyl]-2-(methylthio)acetamide IUPAC Name: N-[1-[2-(azocan-1-yl)-4-methylpyrimidin-5-yl]ethyl]-2-methylsulfanylacetamide Traditional Name: N-[1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-2-(methylthio)acetamide Formula: C17H28N4OS MolecularWeight: 336.49542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(C)NC(=O)CSC)N2CCCCCCC2

Isomeric SMILES

CC1=NC(=NC=C1C(C)NC(=O)CSC)N2CCCCCCC2

InChI

InChI=1S/C17H28N4OS/c1-13(19-16(22)12-23-3)15-11-18-17(20-14(15)2)21-9-7-5-4-6-8-10-21/h11,13H,4-10,12H2,1-3H3,(H,19,22)