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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[5-ethanoyl-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanyl-ethanamide Openeye Name: 2-[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-(1,3-benzodioxol-5-yl)acetamide CAS Name: 2-[[5-acetyl-2-(2-furanyl)-6-methyl-4-pyrimidinyl]thio]-N-(1,3-benzodioxol-5-yl)acetamide IUPAC Name: 2-[5-acetyl-2-(furan-2-yl)-6-methylpyrimidin-4-yl]sulfanyl-N-(1,3-benzodioxol-5-yl)acetamide Traditional Name: 2-[[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]thio]-N-(1,3-benzodioxol-5-yl)acetamide Formula: C20H17N3O5S MolecularWeight: 411.43108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CO2)SCC(=O)NC3=CC4=C(C=C3)OCO4)C(=O)C

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CO2)SCC(=O)NC3=CC4=C(C=C3)OCO4)C(=O)C

InChI

InChI=1S/C20H17N3O5S/c1-11-18(12(2)24)20(23-19(21-11)15-4-3-7-26-15)29-9-17(25)22-13-5-6-14-16(8-13)28-10-27-14/h3-8H,9-10H2,1-2H3,(H,22,25)