N-(2-methyl-4-oxidanylidene-pentan-2-yl)-3-pyrimidin-2-ylsulfanyl-propanamide

Systemtic Name: N-(2-methyl-4-oxidanylidene-pentan-2-yl)-3-pyrimidin-2-ylsulfanyl-propanamide Openeye Name: N-(1,1-dimethyl-3-oxo-butyl)-3-pyrimidin-2-ylsulfanyl-propanamide CAS Name: N-(2-methyl-4-oxopentan-2-yl)-3-(2-pyrimidinylthio)propanamide IUPAC Name: N-(2-methyl-4-oxopentan-2-yl)-3-pyrimidin-2-ylsulfanylpropanamide Traditional Name: N-(3-keto-1,1-dimethyl-butyl)-3-(2-pyrimidylthio)propionamide Formula: C13H19N3O2S MolecularWeight: 281.37386

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C)(C)NC(=O)CCSC1=NC=CC=N1

Isomeric SMILES

CC(=O)CC(C)(C)NC(=O)CCSC1=NC=CC=N1

InChI

InChI=1S/C13H19N3O2S/c1-10(17)9-13(2,3)16-11(18)5-8-19-12-14-6-4-7-15-12/h4,6-7H,5,8-9H2,1-3H3,(H,16,18)