4-(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(oxolan-2-ylcarbonyl)piperazine-2-carboxamide

Systemtic Name: 4-(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(oxolan-2-ylcarbonyl)piperazine-2-carboxamide Openeye Name: 4-(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(tetrahydrofuran-2-carbonyl)piperazine-2-carboxamide CAS Name: 4-[6-chloro-2-(1-imidazolyl)-4-pyrimidinyl]-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-[oxo(2-oxolanyl)methyl]-2-piperazinecarboxamide IUPAC Name: 4-(6-chloro-2-imidazol-1-ylpyrimidin-4-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(oxolane-2-carbonyl)piperazine-2-carboxamide Traditional Name: 4-(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(tetrahydrofuran-2-carbonyl)piperazine-2-carboxamide Formula: C26H28ClN7O5 MolecularWeight: 553.99742

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C(=O)N2CCN(CC2C(=O)NCC3=CC4=C(C=C3)OCCO4)C5=CC(=NC(=N5)N6C=CN=C6)Cl

Isomeric SMILES

C1CC(OC1)C(=O)N2CCN(CC2C(=O)NCC3=CC4=C(C=C3)OCCO4)C5=CC(=NC(=N5)N6C=CN=C6)Cl

InChI

InChI=1S/C26H28ClN7O5/c27-22-13-23(31-26(30-22)33-6-5-28-16-33)32-7-8-34(25(36)20-2-1-9-37-20)18(15-32)24(35)29-14-17-3-4-19-21(12-17)39-11-10-38-19/h3-6,12-13,16,18,20H,1-2,7-11,14-15H2,(H,29,35)