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

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylamino)-4-methyl-N-(3-phenylpropyl)pyrimidine-5-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-ylmethylamino)-4-methyl-N-(3-phenylpropyl)pyrimidine-5-carboxamide CAS Name: 2-(1,3-benzodioxol-5-ylmethylamino)-4-methyl-N-(3-phenylpropyl)-5-pyrimidinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylamino)-4-methyl-N-(3-phenylpropyl)pyrimidine-5-carboxamide Traditional Name: 4-methyl-N-(3-phenylpropyl)-2-(piperonylamino)pyrimidine-5-carboxamide Formula: C23H24N4O3 MolecularWeight: 404.46166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NCCCC2=CC=CC=C2)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NCCCC2=CC=CC=C2)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H24N4O3/c1-16-19(22(28)24-11-5-8-17-6-3-2-4-7-17)14-26-23(27-16)25-13-18-9-10-20-21(12-18)30-15-29-20/h2-4,6-7,9-10,12,14H,5,8,11,13,15H2,1H3,(H,24,28)(H,25,26,27)