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N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide

N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name:N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide
Openeye Name:N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide
CAS Name:N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide
IUPAC Name:N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide
Traditional Name:N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]acetamide
Formula: C22H19N3O4S
MolecularWeight: 421.46896
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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NC3=CC4=C(C=C3C(=O)C)OCO4


Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NC3=CC4=C(C=C3C(=O)C)OCO4


InChI

InChI=1S/C22H19N3O4S/c1-13-8-17(15-6-4-3-5-7-15)25-22(23-13)30-11-21(27)24-18-10-20-19(28-12-29-20)9-16(18)14(2)26/h3-10H,11-12H2,1-2H3,(H,24,27)


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