N-[2-[[6-(ethylamino)-2-methyl-pyrimidin-4-yl]amino]ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[[6-(ethylamino)-2-methyl-pyrimidin-4-yl]amino]ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[[6-(ethylamino)-2-methyl-pyrimidin-4-yl]amino]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[[6-(ethylamino)-2-methyl-4-pyrimidinyl]amino]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[[6-(ethylamino)-2-methylpyrimidin-4-yl]amino]ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[[6-(ethylamino)-2-methyl-pyrimidin-4-yl]amino]ethyl]-piperonylamide Formula: C17H21N5O3 MolecularWeight: 343.38034

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC(=NC(=N1)C)NCCNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCNC1=CC(=NC(=N1)C)NCCNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H21N5O3/c1-3-18-15-9-16(22-11(2)21-15)19-6-7-20-17(23)12-4-5-13-14(8-12)25-10-24-13/h4-5,8-9H,3,6-7,10H2,1-2H3,(H,20,23)(H2,18,19,21,22)