N-(1,3-benzodioxol-5-yl)-4-methyl-2-morpholin-4-yl-pyrimidine-5-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-methyl-2-morpholin-4-yl-pyrimidine-5-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-4-methyl-2-morpholino-pyrimidine-5-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-methyl-2-(4-morpholinyl)-5-pyrimidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-methyl-2-morpholin-4-ylpyrimidine-5-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-methyl-2-morpholino-pyrimidine-5-carboxamide Formula: C17H18N4O4 MolecularWeight: 342.34922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NC2=CC3=C(C=C2)OCO3)N4CCOCC4

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NC2=CC3=C(C=C2)OCO3)N4CCOCC4

InChI

InChI=1S/C17H18N4O4/c1-11-13(9-18-17(19-11)21-4-6-23-7-5-21)16(22)20-12-2-3-14-15(8-12)25-10-24-14/h2-3,8-9H,4-7,10H2,1H3,(H,20,22)