3-chloranyl-2,2-dimethyl-1-[4-(2,5,6-trimethylpyrimidin-4-yl)-1,4-diazepan-1-yl]propan-1-one

Systemtic Name: 3-chloranyl-2,2-dimethyl-1-[4-(2,5,6-trimethylpyrimidin-4-yl)-1,4-diazepan-1-yl]propan-1-one Openeye Name: 3-chloro-2,2-dimethyl-1-[4-(2,5,6-trimethylpyrimidin-4-yl)-1,4-diazepan-1-yl]propan-1-one CAS Name: 3-chloro-2,2-dimethyl-1-[4-(2,5,6-trimethyl-4-pyrimidinyl)-1,4-diazepan-1-yl]-1-propanone IUPAC Name: 3-chloro-2,2-dimethyl-1-[4-(2,5,6-trimethylpyrimidin-4-yl)-1,4-diazepan-1-yl]propan-1-one Traditional Name: 3-chloro-2,2-dimethyl-1-[4-(2,5,6-trimethylpyrimidin-4-yl)-1,4-diazepan-1-yl]propan-1-one Formula: C17H27ClN4O MolecularWeight: 338.87548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1N2CCCN(CC2)C(=O)C(C)(C)CCl)C)C

Isomeric SMILES

CC1=C(N=C(N=C1N2CCCN(CC2)C(=O)C(C)(C)CCl)C)C

InChI

InChI=1S/C17H27ClN4O/c1-12-13(2)19-14(3)20-15(12)21-7-6-8-22(10-9-21)16(23)17(4,5)11-18/h6-11H2,1-5H3