2-[1-butyl-4-(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)piperazin-2-yl]-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)ethanamide

Systemtic Name: 2-[1-butyl-4-(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)piperazin-2-yl]-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)ethanamide Openeye Name: 2-[1-butyl-4-(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)piperazin-2-yl]-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)acetamide CAS Name: 2-[1-butyl-4-[6-chloro-2-(1-imidazolyl)-4-pyrimidinyl]-2-piperazinyl]-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)acetamide IUPAC Name: 2-[1-butyl-4-(6-chloro-2-imidazol-1-ylpyrimidin-4-yl)piperazin-2-yl]-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)acetamide Traditional Name: 2-[1-butyl-4-(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)piperazin-2-yl]-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)acetamide Formula: C26H32ClN7O3 MolecularWeight: 526.03038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1CC(=O)NCC2=CC3=C(C=C2)OCCO3)C4=CC(=NC(=N4)N5C=CN=C5)Cl

Isomeric SMILES

CCCCN1CCN(CC1CC(=O)NCC2=CC3=C(C=C2)OCCO3)C4=CC(=NC(=N4)N5C=CN=C5)Cl

InChI

InChI=1S/C26H32ClN7O3/c1-2-3-7-32-9-10-33(24-15-23(27)30-26(31-24)34-8-6-28-18-34)17-20(32)14-25(35)29-16-19-4-5-21-22(13-19)37-12-11-36-21/h4-6,8,13,15,18,20H,2-3,7,9-12,14,16-17H2,1H3,(H,29,35)