butan-2-yl 4-(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)-2-[(4-methoxyphenyl)methylcarbamoyl]piperazine-1-carboxylate

Systemtic Name: butan-2-yl 4-(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)-2-[(4-methoxyphenyl)methylcarbamoyl]piperazine-1-carboxylate Openeye Name: sec-butyl 4-(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)-2-[(4-methoxyphenyl)methylcarbamoyl]piperazine-1-carboxylate CAS Name: 4-[6-chloro-2-(1-imidazolyl)-4-pyrimidinyl]-2-[[(4-methoxyphenyl)methylamino]-oxomethyl]-1-piperazinecarboxylic acid butan-2-yl ester IUPAC Name: butan-2-yl 4-(6-chloro-2-imidazol-1-ylpyrimidin-4-yl)-2-[(4-methoxyphenyl)methylcarbamoyl]piperazine-1-carboxylate Traditional Name: 4-(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)-2-(p-anisylcarbamoyl)piperazine-1-carboxylic acid sec-butyl ester Formula: C25H30ClN7O4 MolecularWeight: 528.0032

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)N1CCN(CC1C(=O)NCC2=CC=C(C=C2)OC)C3=CC(=NC(=N3)N4C=CN=C4)Cl

Isomeric SMILES

CCC(C)OC(=O)N1CCN(CC1C(=O)NCC2=CC=C(C=C2)OC)C3=CC(=NC(=N3)N4C=CN=C4)Cl

InChI

InChI=1S/C25H30ClN7O4/c1-4-17(2)37-25(35)33-12-11-31(22-13-21(26)29-24(30-22)32-10-9-27-16-32)15-20(33)23(34)28-14-18-5-7-19(36-3)8-6-18/h5-10,13,16-17,20H,4,11-12,14-15H2,1-3H3,(H,28,34)