N-(1,3-benzodioxol-5-ylmethyl)-2-[1-(2-imidazol-1-yl-6-morpholin-4-yl-pyrimidin-4-yl)piperazin-2-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[1-(2-imidazol-1-yl-6-morpholin-4-yl-pyrimidin-4-yl)piperazin-2-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[1-(2-imidazol-1-yl-6-morpholino-pyrimidin-4-yl)piperazin-2-yl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[1-[2-(1-imidazolyl)-6-(4-morpholinyl)-4-pyrimidinyl]-2-piperazinyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[1-(2-imidazol-1-yl-6-morpholin-4-ylpyrimidin-4-yl)piperazin-2-yl]acetamide Traditional Name: 2-[1-(2-imidazol-1-yl-6-morpholino-pyrimidin-4-yl)piperazin-2-yl]-N-piperonyl-acetamide Formula: C25H30N8O4 MolecularWeight: 506.5569

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)CC(=O)NCC2=CC3=C(C=C2)OCO3)C4=NC(=NC(=C4)N5CCOCC5)N6C=CN=C6

Isomeric SMILES

C1CN(C(CN1)CC(=O)NCC2=CC3=C(C=C2)OCO3)C4=NC(=NC(=C4)N5CCOCC5)N6C=CN=C6

InChI

InChI=1S/C25H30N8O4/c34-24(28-14-18-1-2-20-21(11-18)37-17-36-20)12-19-15-26-4-6-33(19)23-13-22(31-7-9-35-10-8-31)29-25(30-23)32-5-3-27-16-32/h1-3,5,11,13,16,19,26H,4,6-10,12,14-15,17H2,(H,28,34)