2-[1-(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)-4-methylsulfonyl-piperazin-2-yl]-N-[(3-chloranyl-4-methoxy-phenyl)methyl]ethanamide

Systemtic Name: 2-[1-(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)-4-methylsulfonyl-piperazin-2-yl]-N-[(3-chloranyl-4-methoxy-phenyl)methyl]ethanamide Openeye Name: 2-[1-(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)-4-methylsulfonyl-piperazin-2-yl]-N-[(3-chloro-4-methoxy-phenyl)methyl]acetamide CAS Name: 2-[1-[6-chloro-2-(1-imidazolyl)-4-pyrimidinyl]-4-methylsulfonyl-2-piperazinyl]-N-[(3-chloro-4-methoxyphenyl)methyl]acetamide IUPAC Name: 2-[1-(6-chloro-2-imidazol-1-ylpyrimidin-4-yl)-4-methylsulfonylpiperazin-2-yl]-N-[(3-chloro-4-methoxyphenyl)methyl]acetamide Traditional Name: 2-[1-(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)-4-mesyl-piperazin-2-yl]-N-(3-chloro-4-methoxy-benzyl)acetamide Formula: C22H25Cl2N7O4S MolecularWeight: 554.4494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CC2CN(CCN2C3=CC(=NC(=N3)N4C=CN=C4)Cl)S(=O)(=O)C)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CC2CN(CCN2C3=CC(=NC(=N3)N4C=CN=C4)Cl)S(=O)(=O)C)Cl

InChI

InChI=1S/C22H25Cl2N7O4S/c1-35-18-4-3-15(9-17(18)23)12-26-21(32)10-16-13-30(36(2,33)34)7-8-31(16)20-11-19(24)27-22(28-20)29-6-5-25-14-29/h3-6,9,11,14,16H,7-8,10,12-13H2,1-2H3,(H,26,32)