N-(3-methylbutylcarbamoyl)-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(3-methylbutylcarbamoyl)-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-(isopentylcarbamoyl)-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[(3-methylbutylamino)-oxomethyl]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-(3-methylbutylcarbamoyl)-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-(isoamylcarbamoyl)-2-(2-pyrimidylthio)acetamide Formula: C12H18N4O2S MolecularWeight: 282.36192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)CSC1=NC=CC=N1

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)CSC1=NC=CC=N1

InChI

InChI=1S/C12H18N4O2S/c1-9(2)4-7-13-11(18)16-10(17)8-19-12-14-5-3-6-15-12/h3,5-6,9H,4,7-8H2,1-2H3,(H2,13,16,17,18)