N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[4-ethanoyl-1-(2-imidazol-1-yl-6-propan-2-yl-pyrimidin-4-yl)piperazin-2-yl]ethanamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[4-ethanoyl-1-(2-imidazol-1-yl-6-propan-2-yl-pyrimidin-4-yl)piperazin-2-yl]ethanamide Openeye Name: 2-[4-acetyl-1-(2-imidazol-1-yl-6-isopropyl-pyrimidin-4-yl)piperazin-2-yl]-N-[2-(1,3-benzodioxol-5-yl)ethyl]acetamide CAS Name: 2-[4-acetyl-1-[2-(1-imidazolyl)-6-propan-2-yl-4-pyrimidinyl]-2-piperazinyl]-N-[2-(1,3-benzodioxol-5-yl)ethyl]acetamide IUPAC Name: 2-[4-acetyl-1-(2-imidazol-1-yl-6-propan-2-ylpyrimidin-4-yl)piperazin-2-yl]-N-[2-(1,3-benzodioxol-5-yl)ethyl]acetamide Traditional Name: 2-[4-acetyl-1-(2-imidazol-1-yl-6-isopropyl-pyrimidin-4-yl)piperazin-2-yl]-N-homopiperonyl-acetamide Formula: C27H33N7O4 MolecularWeight: 519.59542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NC(=N1)N2C=CN=C2)N3CCN(CC3CC(=O)NCCC4=CC5=C(C=C4)OCO5)C(=O)C

Isomeric SMILES

CC(C)C1=CC(=NC(=N1)N2C=CN=C2)N3CCN(CC3CC(=O)NCCC4=CC5=C(C=C4)OCO5)C(=O)C

InChI

InChI=1S/C27H33N7O4/c1-18(2)22-14-25(31-27(30-22)33-9-8-28-16-33)34-11-10-32(19(3)35)15-21(34)13-26(36)29-7-6-20-4-5-23-24(12-20)38-17-37-23/h4-5,8-9,12,14,16,18,21H,6-7,10-11,13,15,17H2,1-3H3,(H,29,36)