1-[4-(2,6-dimethyl-5-propan-2-yl-pyrimidin-4-yl)-1,4-diazepan-1-yl]heptan-1-one

Systemtic Name: 1-[4-(2,6-dimethyl-5-propan-2-yl-pyrimidin-4-yl)-1,4-diazepan-1-yl]heptan-1-one Openeye Name: 1-[4-(5-isopropyl-2,6-dimethyl-pyrimidin-4-yl)-1,4-diazepan-1-yl]heptan-1-one CAS Name: 1-[4-(2,6-dimethyl-5-propan-2-yl-4-pyrimidinyl)-1,4-diazepan-1-yl]-1-heptanone IUPAC Name: 1-[4-(2,6-dimethyl-5-propan-2-ylpyrimidin-4-yl)-1,4-diazepan-1-yl]heptan-1-one Traditional Name: 1-[4-(5-isopropyl-2,6-dimethyl-pyrimidin-4-yl)-1,4-diazepan-1-yl]heptan-1-one Formula: C21H36N4O MolecularWeight: 360.53674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)N1CCCN(CC1)C2=NC(=NC(=C2C(C)C)C)C

Isomeric SMILES

CCCCCCC(=O)N1CCCN(CC1)C2=NC(=NC(=C2C(C)C)C)C

InChI

InChI=1S/C21H36N4O/c1-6-7-8-9-11-19(26)24-12-10-13-25(15-14-24)21-20(16(2)3)17(4)22-18(5)23-21/h16H,6-15H2,1-5H3