2-methoxyethyl 2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylcarbamoyl)-4-(6-imidazol-1-ylpyrimidin-4-yl)piperazine-1-carboxylate

Systemtic Name: 2-methoxyethyl 2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylcarbamoyl)-4-(6-imidazol-1-ylpyrimidin-4-yl)piperazine-1-carboxylate Openeye Name: 2-methoxyethyl 2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylcarbamoyl)-4-(6-imidazol-1-ylpyrimidin-4-yl)piperazine-1-carboxylate CAS Name: 2-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-oxomethyl]-4-[6-(1-imidazolyl)-4-pyrimidinyl]-1-piperazinecarboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylcarbamoyl)-4-(6-imidazol-1-ylpyrimidin-4-yl)piperazine-1-carboxylate Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylcarbamoyl)-4-(6-imidazol-1-ylpyrimidin-4-yl)piperazine-1-carboxylic acid 2-methoxyethyl ester Formula: C25H29N7O6 MolecularWeight: 523.54106

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)N1CCN(CC1C(=O)NCC2=CC3=C(C=C2)OCCO3)C4=NC=NC(=C4)N5C=CN=C5

Isomeric SMILES

COCCOC(=O)N1CCN(CC1C(=O)NCC2=CC3=C(C=C2)OCCO3)C4=NC=NC(=C4)N5C=CN=C5

InChI

InChI=1S/C25H29N7O6/c1-35-8-9-38-25(34)32-7-6-30(22-13-23(29-16-28-22)31-5-4-26-17-31)15-19(32)24(33)27-14-18-2-3-20-21(12-18)37-11-10-36-20/h2-5,12-13,16-17,19H,6-11,14-15H2,1H3,(H,27,33)