(4-methoxyphenyl) 4-(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)-3-[(3-chloranyl-4-methoxy-phenyl)methylcarbamoyl]piperazine-1-carboxylate

Systemtic Name: (4-methoxyphenyl) 4-(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)-3-[(3-chloranyl-4-methoxy-phenyl)methylcarbamoyl]piperazine-1-carboxylate Openeye Name: (4-methoxyphenyl) 4-(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)-3-[(3-chloro-4-methoxy-phenyl)methylcarbamoyl]piperazine-1-carboxylate CAS Name: 4-[6-chloro-2-(1-imidazolyl)-4-pyrimidinyl]-3-[[(3-chloro-4-methoxyphenyl)methylamino]-oxomethyl]-1-piperazinecarboxylic acid (4-methoxyphenyl) ester IUPAC Name: (4-methoxyphenyl) 4-(6-chloro-2-imidazol-1-ylpyrimidin-4-yl)-3-[(3-chloro-4-methoxyphenyl)methylcarbamoyl]piperazine-1-carboxylate Traditional Name: 4-(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)-3-[(3-chloro-4-methoxy-benzyl)carbamoyl]piperazine-1-carboxylic acid (4-methoxyphenyl) ester Formula: C28H27Cl2N7O5 MolecularWeight: 612.46388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC(=O)N2CCN(C(C2)C(=O)NCC3=CC(=C(C=C3)OC)Cl)C4=CC(=NC(=N4)N5C=CN=C5)Cl

Isomeric SMILES

COC1=CC=C(C=C1)OC(=O)N2CCN(C(C2)C(=O)NCC3=CC(=C(C=C3)OC)Cl)C4=CC(=NC(=N4)N5C=CN=C5)Cl

InChI

InChI=1S/C28H27Cl2N7O5/c1-40-19-4-6-20(7-5-19)42-28(39)35-11-12-37(25-14-24(30)33-27(34-25)36-10-9-31-17-36)22(16-35)26(38)32-15-18-3-8-23(41-2)21(29)13-18/h3-10,13-14,17,22H,11-12,15-16H2,1-2H3,(H,32,38)