3-(5-ethanoyl-2-ethyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]propanamide

Systemtic Name: 3-(5-ethanoyl-2-ethyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]propanamide Openeye Name: 3-(5-acetyl-2-ethyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide CAS Name: 3-[(5-acetyl-2-ethyl-6-methyl-4-pyrimidinyl)thio]-N-[4-(2-oxo-1-pyrrolidinyl)phenyl]propanamide IUPAC Name: 3-(5-acetyl-2-ethyl-6-methylpyrimidin-4-yl)sulfanyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide Traditional Name: 3-[(5-acetyl-2-ethyl-6-methyl-pyrimidin-4-yl)thio]-N-[4-(2-ketopyrrolidino)phenyl]propionamide Formula: C22H26N4O3S MolecularWeight: 426.53184

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(C(=N1)SCCC(=O)NC2=CC=C(C=C2)N3CCCC3=O)C(=O)C)C

Isomeric SMILES

CCC1=NC(=C(C(=N1)SCCC(=O)NC2=CC=C(C=C2)N3CCCC3=O)C(=O)C)C

InChI

InChI=1S/C22H26N4O3S/c1-4-18-23-14(2)21(15(3)27)22(25-18)30-13-11-19(28)24-16-7-9-17(10-8-16)26-12-5-6-20(26)29/h7-10H,4-6,11-13H2,1-3H3,(H,24,28)