2-[4-[2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanylethanoyl]piperazin-1-yl]-N-tert-butyl-ethanamide

Systemtic Name: 2-[4-[2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanylethanoyl]piperazin-1-yl]-N-tert-butyl-ethanamide Openeye Name: 2-[4-[2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanylacetyl]piperazin-1-yl]-N-tert-butyl-acetamide CAS Name: 2-[4-[2-[(4-amino-6-methyl-2-pyrimidinyl)thio]-1-oxoethyl]-1-piperazinyl]-N-tert-butylacetamide IUPAC Name: 2-[4-[2-(4-amino-6-methylpyrimidin-2-yl)sulfanylacetyl]piperazin-1-yl]-N-tert-butylacetamide Traditional Name: 2-[4-[2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]acetyl]piperazino]-N-tert-butyl-acetamide Formula: C17H28N6O2S MolecularWeight: 380.50822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N2CCN(CC2)CC(=O)NC(C)(C)C)N

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N2CCN(CC2)CC(=O)NC(C)(C)C)N

InChI

InChI=1S/C17H28N6O2S/c1-12-9-13(18)20-16(19-12)26-11-15(25)23-7-5-22(6-8-23)10-14(24)21-17(2,3)4/h9H,5-8,10-11H2,1-4H3,(H,21,24)(H2,18,19,20)