2-methoxyethyl 4-(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)-2-[2-(3-methoxyphenyl)ethylcarbamoyl]piperazine-1-carboxylate

Systemtic Name: 2-methoxyethyl 4-(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)-2-[2-(3-methoxyphenyl)ethylcarbamoyl]piperazine-1-carboxylate Openeye Name: 2-methoxyethyl 4-(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)-2-[2-(3-methoxyphenyl)ethylcarbamoyl]piperazine-1-carboxylate CAS Name: 4-[6-chloro-2-(1-imidazolyl)-4-pyrimidinyl]-2-[[2-(3-methoxyphenyl)ethylamino]-oxomethyl]-1-piperazinecarboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-(6-chloro-2-imidazol-1-ylpyrimidin-4-yl)-2-[2-(3-methoxyphenyl)ethylcarbamoyl]piperazine-1-carboxylate Traditional Name: 4-(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)-2-[2-(3-methoxyphenyl)ethylcarbamoyl]piperazine-1-carboxylic acid 2-methoxyethyl ester Formula: C25H30ClN7O5 MolecularWeight: 544.0026

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)N1CCN(CC1C(=O)NCCC2=CC(=CC=C2)OC)C3=CC(=NC(=N3)N4C=CN=C4)Cl

Isomeric SMILES

COCCOC(=O)N1CCN(CC1C(=O)NCCC2=CC(=CC=C2)OC)C3=CC(=NC(=N3)N4C=CN=C4)Cl

InChI

InChI=1S/C25H30ClN7O5/c1-36-12-13-38-25(35)33-11-10-31(22-15-21(26)29-24(30-22)32-9-8-27-17-32)16-20(33)23(34)28-7-6-18-4-3-5-19(14-18)37-2/h3-5,8-9,14-15,17,20H,6-7,10-13,16H2,1-2H3,(H,28,34)