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

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylamino)-N-cyclohexyl-4-methyl-pyrimidine-5-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-ylmethylamino)-N-cyclohexyl-4-methyl-pyrimidine-5-carboxamide CAS Name: 2-(1,3-benzodioxol-5-ylmethylamino)-N-cyclohexyl-4-methyl-5-pyrimidinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylamino)-N-cyclohexyl-4-methylpyrimidine-5-carboxamide Traditional Name: N-cyclohexyl-4-methyl-2-(piperonylamino)pyrimidine-5-carboxamide Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NC2CCCCC2)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NC2CCCCC2)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H24N4O3/c1-13-16(19(25)24-15-5-3-2-4-6-15)11-22-20(23-13)21-10-14-7-8-17-18(9-14)27-12-26-17/h7-9,11,15H,2-6,10,12H2,1H3,(H,24,25)(H,21,22,23)