N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-imidazol-1-yl-6-propan-2-yl-pyrimidin-4-yl)-1-(3-methylbutanoyl)piperazine-2-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-imidazol-1-yl-6-propan-2-yl-pyrimidin-4-yl)-1-(3-methylbutanoyl)piperazine-2-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-imidazol-1-yl-6-isopropyl-pyrimidin-4-yl)-1-(3-methylbutanoyl)piperazine-2-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[2-(1-imidazolyl)-6-propan-2-yl-4-pyrimidinyl]-1-(3-methyl-1-oxobutyl)-2-piperazinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-imidazol-1-yl-6-propan-2-ylpyrimidin-4-yl)-1-(3-methylbutanoyl)piperazine-2-carboxamide Traditional Name: N-homoveratryl-4-(2-imidazol-1-yl-6-isopropyl-pyrimidin-4-yl)-1-isovaleryl-piperazine-2-carboxamide Formula: C30H41N7O4 MolecularWeight: 563.69104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(CC1C(=O)NCCC2=CC(=C(C=C2)OC)OC)C3=NC(=NC(=C3)C(C)C)N4C=CN=C4

Isomeric SMILES

CC(C)CC(=O)N1CCN(CC1C(=O)NCCC2=CC(=C(C=C2)OC)OC)C3=NC(=NC(=C3)C(C)C)N4C=CN=C4

InChI

InChI=1S/C30H41N7O4/c1-20(2)15-28(38)37-14-13-35(27-17-23(21(3)4)33-30(34-27)36-12-11-31-19-36)18-24(37)29(39)32-10-9-22-7-8-25(40-5)26(16-22)41-6/h7-8,11-12,16-17,19-21,24H,9-10,13-15,18H2,1-6H3,(H,32,39)