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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-imidazol-1-yl-6-propan-2-yl-1H-pyrimidin-4-yl)-4-(2-phenoxyethanoyl)piperazine-2-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-imidazol-1-yl-6-isopropyl-1H-pyrimidin-4-yl)-4-(2-phenoxyacetyl)piperazine-2-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[4-(1-imidazolyl)-6-propan-2-yl-1H-pyrimidin-4-yl]-4-(1-oxo-2-phenoxyethyl)-2-piperazinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-imidazol-1-yl-6-propan-2-yl-1H-pyrimidin-4-yl)-4-(2-phenoxyacetyl)piperazine-2-carboxamide Traditional Name: N-homoveratryl-1-(4-imidazol-1-yl-6-isopropyl-1H-pyrimidin-4-yl)-4-(2-phenoxyacetyl)piperazine-2-carboxamide Formula: C33H41N7O5 MolecularWeight: 615.72254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(N=CN1)(N2CCN(CC2C(=O)NCCC3=CC(=C(C=C3)OC)OC)C(=O)COC4=CC=CC=C4)N5C=CN=C5

Isomeric SMILES

CC(C)C1=CC(N=CN1)(N2CCN(CC2C(=O)NCCC3=CC(=C(C=C3)OC)OC)C(=O)COC4=CC=CC=C4)N5C=CN=C5

InChI

InChI=1S/C33H41N7O5/c1-24(2)27-19-33(37-22-36-27,39-15-14-34-23-39)40-17-16-38(31(41)21-45-26-8-6-5-7-9-26)20-28(40)32(42)35-13-12-25-10-11-29(43-3)30(18-25)44-4/h5-11,14-15,18-19,22-24,28H,12-13,16-17,20-21H2,1-4H3,(H,35,42)(H,36,37)