N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(5-ethanoyl-2,6-dimethyl-pyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(5-ethanoyl-2,6-dimethyl-pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: 2-(5-acetyl-2,6-dimethyl-pyrimidin-4-yl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)acetamide CAS Name: 2-[(5-acetyl-2,6-dimethyl-4-pyrimidinyl)thio]-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)acetamide IUPAC Name: 2-(5-acetyl-2,6-dimethylpyrimidin-4-yl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)acetamide Traditional Name: 2-[(5-acetyl-2,6-dimethyl-pyrimidin-4-yl)thio]-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)acetamide Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)SCC(=O)NCC2COC3=CC=CC=C3O2)C(=O)C

Isomeric SMILES

CC1=C(C(=NC(=N1)C)SCC(=O)NCC2COC3=CC=CC=C3O2)C(=O)C

InChI

InChI=1S/C19H21N3O4S/c1-11-18(12(2)23)19(22-13(3)21-11)27-10-17(24)20-8-14-9-25-15-6-4-5-7-16(15)26-14/h4-7,14H,8-10H2,1-3H3,(H,20,24)