propan-2-yl 2-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethylcarbamoyl]-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperazine-1-carboxylate

Systemtic Name: propan-2-yl 2-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethylcarbamoyl]-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperazine-1-carboxylate Openeye Name: isopropyl 2-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethylcarbamoyl]-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperazine-1-carboxylate CAS Name: 2-[[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethylamino]-oxomethyl]-4-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-1-piperazinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethylcarbamoyl]-4-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)piperazine-1-carboxylate Traditional Name: 2-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethylcarbamoyl]-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperazine-1-carboxylic acid isopropyl ester Formula: C27H33N7O5 MolecularWeight: 535.59482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCN(C(C3)C(=O)NCCC4COC5=CC=CC=C5O4)C(=O)OC(C)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCN(C(C3)C(=O)NCCC4COC5=CC=CC=C5O4)C(=O)OC(C)C

InChI

InChI=1S/C27H33N7O5/c1-18(2)38-27(36)34-13-12-32(24-14-19(3)30-26(31-24)33-11-10-28-17-33)15-21(34)25(35)29-9-8-20-16-37-22-6-4-5-7-23(22)39-20/h4-7,10-11,14,17-18,20-21H,8-9,12-13,15-16H2,1-3H3,(H,29,35)