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

Systemtic Name: 2-[4-butyl-1-(2-imidazol-1-yl-6-propan-2-yl-pyrimidin-4-yl)piperazin-2-yl]-N-[(3-chloranyl-4-methoxy-phenyl)methyl]ethanamide Openeye Name: 2-[4-butyl-1-(2-imidazol-1-yl-6-isopropyl-pyrimidin-4-yl)piperazin-2-yl]-N-[(3-chloro-4-methoxy-phenyl)methyl]acetamide CAS Name: 2-[4-butyl-1-[2-(1-imidazolyl)-6-propan-2-yl-4-pyrimidinyl]-2-piperazinyl]-N-[(3-chloro-4-methoxyphenyl)methyl]acetamide IUPAC Name: 2-[4-butyl-1-(2-imidazol-1-yl-6-propan-2-ylpyrimidin-4-yl)piperazin-2-yl]-N-[(3-chloro-4-methoxyphenyl)methyl]acetamide Traditional Name: 2-[4-butyl-1-(2-imidazol-1-yl-6-isopropyl-pyrimidin-4-yl)piperazin-2-yl]-N-(3-chloro-4-methoxy-benzyl)acetamide Formula: C28H38ClN7O2 MolecularWeight: 540.10002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(C(C1)CC(=O)NCC2=CC(=C(C=C2)OC)Cl)C3=NC(=NC(=C3)C(C)C)N4C=CN=C4

Isomeric SMILES

CCCCN1CCN(C(C1)CC(=O)NCC2=CC(=C(C=C2)OC)Cl)C3=NC(=NC(=C3)C(C)C)N4C=CN=C4

InChI

InChI=1S/C28H38ClN7O2/c1-5-6-10-34-12-13-36(26-16-24(20(2)3)32-28(33-26)35-11-9-30-19-35)22(18-34)15-27(37)31-17-21-7-8-25(38-4)23(29)14-21/h7-9,11,14,16,19-20,22H,5-6,10,12-13,15,17-18H2,1-4H3,(H,31,37)