propan-2-yl 4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-2-[2-(4-methylphenoxy)ethylcarbamoyl]piperazine-1-carboxylate

Systemtic Name: propan-2-yl 4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-2-[2-(4-methylphenoxy)ethylcarbamoyl]piperazine-1-carboxylate Openeye Name: isopropyl 4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-2-[2-(4-methylphenoxy)ethylcarbamoyl]piperazine-1-carboxylate CAS Name: 4-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-2-[[2-(4-methylphenoxy)ethylamino]-oxomethyl]-1-piperazinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)-2-[2-(4-methylphenoxy)ethylcarbamoyl]piperazine-1-carboxylate Traditional Name: 4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-2-[2-(4-methylphenoxy)ethylcarbamoyl]piperazine-1-carboxylic acid isopropyl ester Formula: C26H33N7O4 MolecularWeight: 507.58472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCNC(=O)C2CN(CCN2C(=O)OC(C)C)C3=NC(=NC(=C3)C)N4C=CN=C4

Isomeric SMILES

CC1=CC=C(C=C1)OCCNC(=O)C2CN(CCN2C(=O)OC(C)C)C3=NC(=NC(=C3)C)N4C=CN=C4

InChI

InChI=1S/C26H33N7O4/c1-18(2)37-26(35)33-13-12-31(23-15-20(4)29-25(30-23)32-11-9-27-17-32)16-22(33)24(34)28-10-14-36-21-7-5-19(3)6-8-21/h5-9,11,15,17-18,22H,10,12-14,16H2,1-4H3,(H,28,34)