N-(4-ethoxyphenyl)-2-pyrimidin-2-ylsulfanyl-butanamide

Systemtic Name: N-(4-ethoxyphenyl)-2-pyrimidin-2-ylsulfanyl-butanamide Openeye Name: N-(4-ethoxyphenyl)-2-pyrimidin-2-ylsulfanyl-butanamide CAS Name: N-(4-ethoxyphenyl)-2-(2-pyrimidinylthio)butanamide IUPAC Name: N-(4-ethoxyphenyl)-2-pyrimidin-2-ylsulfanylbutanamide Traditional Name: N-p-phenetyl-2-(2-pyrimidylthio)butyramide Formula: C16H19N3O2S MolecularWeight: 317.40596

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)OCC)SC2=NC=CC=N2

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)OCC)SC2=NC=CC=N2

InChI

InChI=1S/C16H19N3O2S/c1-3-14(22-16-17-10-5-11-18-16)15(20)19-12-6-8-13(9-7-12)21-4-2/h5-11,14H,3-4H2,1-2H3,(H,19,20)