3-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)-N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)propanamide

Systemtic Name: 3-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)-N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)propanamide Openeye Name: 3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)-N-[4-ethoxy-3-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: 3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)-N-[4-ethoxy-3-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: 3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)-N-(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-(4-ethoxy-3-piperidinosulfonyl-phenyl)-3-(4-keto-2,6-dimethyl-1H-pyrimidin-5-yl)propionamide Formula: C22H30N4O5S MolecularWeight: 462.5624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CCC2=C(NC(=NC2=O)C)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CCC2=C(NC(=NC2=O)C)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H30N4O5S/c1-4-31-19-10-8-17(14-20(19)32(29,30)26-12-6-5-7-13-26)25-21(27)11-9-18-15(2)23-16(3)24-22(18)28/h8,10,14H,4-7,9,11-13H2,1-3H3,(H,25,27)(H,23,24,28)