N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(4-fluorophenyl)-6-oxidanylidene-pyrimidin-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(4-fluorophenyl)-6-oxidanylidene-pyrimidin-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(4-fluorophenyl)-6-oxo-pyrimidin-1-yl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(4-fluorophenyl)-6-oxo-1-pyrimidinyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(4-fluorophenyl)-6-oxopyrimidin-1-yl]acetamide Traditional Name: 2-[4-(4-fluorophenyl)-6-keto-pyrimidin-1-yl]-N-piperonyl-acetamide Formula: C20H16FN3O4 MolecularWeight: 381.357143

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CN3C=NC(=CC3=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CN3C=NC(=CC3=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H16FN3O4/c21-15-4-2-14(3-5-15)16-8-20(26)24(11-23-16)10-19(25)22-9-13-1-6-17-18(7-13)28-12-27-17/h1-8,11H,9-10,12H2,(H,22,25)