N-[1-(4-methyl-2-pyridin-4-yl-pyrimidin-5-yl)ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[1-(4-methyl-2-pyridin-4-yl-pyrimidin-5-yl)ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[1-[4-methyl-2-(4-pyridyl)pyrimidin-5-yl]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[1-(4-methyl-2-pyridin-4-yl-5-pyrimidinyl)ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[1-[4-methyl-2-(4-pyridyl)pyrimidin-5-yl]ethyl]-piperonylamide Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(C)NC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=NC=C4

Isomeric SMILES

CC1=NC(=NC=C1C(C)NC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=NC=C4

InChI

InChI=1S/C20H18N4O3/c1-12-16(10-22-19(23-12)14-5-7-21-8-6-14)13(2)24-20(25)15-3-4-17-18(9-15)27-11-26-17/h3-10,13H,11H2,1-2H3,(H,24,25)