N-(3-ethanoylphenyl)-2-[6-(4-methoxyphenyl)pyrimidin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-ethanoylphenyl)-2-[6-(4-methoxyphenyl)pyrimidin-4-yl]sulfanyl-ethanamide Openeye Name: N-(3-acetylphenyl)-2-[6-(4-methoxyphenyl)pyrimidin-4-yl]sulfanyl-acetamide CAS Name: N-(3-acetylphenyl)-2-[[6-(4-methoxyphenyl)-4-pyrimidinyl]thio]acetamide IUPAC Name: N-(3-acetylphenyl)-2-[6-(4-methoxyphenyl)pyrimidin-4-yl]sulfanylacetamide Traditional Name: N-(3-acetylphenyl)-2-[[6-(4-methoxyphenyl)pyrimidin-4-yl]thio]acetamide Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC=NC(=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC=NC(=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H19N3O3S/c1-14(25)16-4-3-5-17(10-16)24-20(26)12-28-21-11-19(22-13-23-21)15-6-8-18(27-2)9-7-15/h3-11,13H,12H2,1-2H3,(H,24,26)