2-(1,3-benzodioxol-5-ylmethylamino)-4-methyl-N-(3-propan-2-yloxypropyl)pyrimidine-5-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylamino)-4-methyl-N-(3-propan-2-yloxypropyl)pyrimidine-5-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-ylmethylamino)-N-(3-isopropoxypropyl)-4-methyl-pyrimidine-5-carboxamide CAS Name: 2-(1,3-benzodioxol-5-ylmethylamino)-4-methyl-N-(3-propan-2-yloxypropyl)-5-pyrimidinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylamino)-4-methyl-N-(3-propan-2-yloxypropyl)pyrimidine-5-carboxamide Traditional Name: N-(3-isopropoxypropyl)-4-methyl-2-(piperonylamino)pyrimidine-5-carboxamide Formula: C20H26N4O4 MolecularWeight: 386.44484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NCCCOC(C)C)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NCCCOC(C)C)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H26N4O4/c1-13(2)26-8-4-7-21-19(25)16-11-23-20(24-14(16)3)22-10-15-5-6-17-18(9-15)28-12-27-17/h5-6,9,11,13H,4,7-8,10,12H2,1-3H3,(H,21,25)(H,22,23,24)