N2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-(2-imidazol-1-ylpyrimidin-4-yl)-N1-propyl-piperazine-1,2-dicarboxamide

Systemtic Name: N2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-(2-imidazol-1-ylpyrimidin-4-yl)-N1-propyl-piperazine-1,2-dicarboxamide Openeye Name: N2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-(2-imidazol-1-ylpyrimidin-4-yl)-N1-propyl-piperazine-1,2-dicarboxamide CAS Name: N2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-[2-(1-imidazolyl)-4-pyrimidinyl]-N1-propylpiperazine-1,2-dicarboxamide IUPAC Name: 2-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-(2-imidazol-1-ylpyrimidin-4-yl)-1-N-propylpiperazine-1,2-dicarboxamide Traditional Name: N'-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-(2-imidazol-1-ylpyrimidin-4-yl)-N-propyl-piperazine-1,2-dicarboxamide Formula: C26H32N8O4 MolecularWeight: 520.58348

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N1CCN(CC1C(=O)NCCC2=CC3=C(C=C2)OCCO3)C4=NC(=NC=C4)N5C=CN=C5

Isomeric SMILES

CCCNC(=O)N1CCN(CC1C(=O)NCCC2=CC3=C(C=C2)OCCO3)C4=NC(=NC=C4)N5C=CN=C5

InChI

InChI=1S/C26H32N8O4/c1-2-7-30-26(36)34-13-12-32(23-6-9-29-25(31-23)33-11-10-27-18-33)17-20(34)24(35)28-8-5-19-3-4-21-22(16-19)38-15-14-37-21/h3-4,6,9-11,16,18,20H,2,5,7-8,12-15,17H2,1H3,(H,28,35)(H,30,36)