4-(1,3-benzodioxol-5-yloxy)-2-(4-methylphenyl)-N-propan-2-yl-pyrimidine-5-carboxamide

Systemtic Name: 4-(1,3-benzodioxol-5-yloxy)-2-(4-methylphenyl)-N-propan-2-yl-pyrimidine-5-carboxamide Openeye Name: 4-(1,3-benzodioxol-5-yloxy)-N-isopropyl-2-(p-tolyl)pyrimidine-5-carboxamide CAS Name: 4-(1,3-benzodioxol-5-yloxy)-2-(4-methylphenyl)-N-propan-2-yl-5-pyrimidinecarboxamide IUPAC Name: 4-(1,3-benzodioxol-5-yloxy)-2-(4-methylphenyl)-N-propan-2-ylpyrimidine-5-carboxamide Traditional Name: 4-(1,3-benzodioxol-5-yloxy)-N-isopropyl-2-(p-tolyl)pyrimidine-5-carboxamide Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC=C(C(=N2)OC3=CC4=C(C=C3)OCO4)C(=O)NC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC=C(C(=N2)OC3=CC4=C(C=C3)OCO4)C(=O)NC(C)C

InChI

InChI=1S/C22H21N3O4/c1-13(2)24-21(26)17-11-23-20(15-6-4-14(3)5-7-15)25-22(17)29-16-8-9-18-19(10-16)28-12-27-18/h4-11,13H,12H2,1-3H3,(H,24,26)