N-(2-ethoxyphenyl)-3-(6-phenylpyrimidin-4-yl)sulfanyl-propanamide

Systemtic Name: N-(2-ethoxyphenyl)-3-(6-phenylpyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-(2-ethoxyphenyl)-3-(6-phenylpyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-(2-ethoxyphenyl)-3-[(6-phenyl-4-pyrimidinyl)thio]propanamide IUPAC Name: N-(2-ethoxyphenyl)-3-(6-phenylpyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-o-phenetyl-3-[(6-phenylpyrimidin-4-yl)thio]propionamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)CCSC2=NC=NC(=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)CCSC2=NC=NC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2S/c1-2-26-19-11-7-6-10-17(19)24-20(25)12-13-27-21-14-18(22-15-23-21)16-8-4-3-5-9-16/h3-11,14-15H,2,12-13H2,1H3,(H,24,25)