N-(2-ethoxyphenyl)-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-ethoxyphenyl)-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(2-ethoxyphenyl)-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(2-ethoxyphenyl)-2-[[6-(1-pyrrolidinyl)-4-pyrimidinyl]thio]acetamide IUPAC Name: N-(2-ethoxyphenyl)-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanylacetamide Traditional Name: N-o-phenetyl-2-[(6-pyrrolidinopyrimidin-4-yl)thio]acetamide Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)CSC2=NC=NC(=C2)N3CCCC3

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)CSC2=NC=NC(=C2)N3CCCC3

InChI

InChI=1S/C18H22N4O2S/c1-2-24-15-8-4-3-7-14(15)21-17(23)12-25-18-11-16(19-13-20-18)22-9-5-6-10-22/h3-4,7-8,11,13H,2,5-6,9-10,12H2,1H3,(H,21,23)