2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]ethanone Openeye Name: 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]ethanone CAS Name: 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanone Traditional Name: 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]ethanone Formula: C22H27ClN4O3 MolecularWeight: 430.92778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)CC3=CC4=C(C(=C3)Cl)OCCO4

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)CC3=CC4=C(C(=C3)Cl)OCCO4

InChI

InChI=1S/C22H27ClN4O3/c1-14(2)22-24-15(3)10-19(25-22)26-4-6-27(7-5-26)20(28)13-16-11-17(23)21-18(12-16)29-8-9-30-21/h10-12,14H,4-9,13H2,1-3H3