2-(1,3-benzodioxol-5-ylmethylamino)-N-[2-(4-ethoxyphenyl)ethyl]-4-methyl-pyrimidine-5-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylamino)-N-[2-(4-ethoxyphenyl)ethyl]-4-methyl-pyrimidine-5-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-ylmethylamino)-N-[2-(4-ethoxyphenyl)ethyl]-4-methyl-pyrimidine-5-carboxamide CAS Name: 2-(1,3-benzodioxol-5-ylmethylamino)-N-[2-(4-ethoxyphenyl)ethyl]-4-methyl-5-pyrimidinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylamino)-N-[2-(4-ethoxyphenyl)ethyl]-4-methylpyrimidine-5-carboxamide Traditional Name: 4-methyl-2-(piperonylamino)-N-(2-p-phenetylethyl)pyrimidine-5-carboxamide Formula: C24H26N4O4 MolecularWeight: 434.48764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CCNC(=O)C2=CN=C(N=C2C)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC1=CC=C(C=C1)CCNC(=O)C2=CN=C(N=C2C)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H26N4O4/c1-3-30-19-7-4-17(5-8-19)10-11-25-23(29)20-14-27-24(28-16(20)2)26-13-18-6-9-21-22(12-18)32-15-31-21/h4-9,12,14H,3,10-11,13,15H2,1-2H3,(H,25,29)(H,26,27,28)