1,3-dimethyl-7-[2-[methyl(6-methylheptan-2-yl)amino]ethyl]purine-2,6-dione; iodanylmethane

Systemtic Name: 1,3-dimethyl-7-[2-[methyl(6-methylheptan-2-yl)amino]ethyl]purine-2,6-dione; iodanylmethane Openeye Name: 7-[2-[1,5-dimethylhexyl(methyl)amino]ethyl]-1,3-dimethyl-purine-2,6-dione; iodomethane CAS Name: 1,3-dimethyl-7-[2-[methyl(6-methylheptan-2-yl)amino]ethyl]purine-2,6-dione; iodomethane IUPAC Name: 1,3-dimethyl-7-[2-[methyl(6-methylheptan-2-yl)amino]ethyl]purine-2,6-dione; iodomethane Traditional Name: 7-[2-[1,5-dimethylhexyl(methyl)amino]ethyl]-1,3-dimethyl-xanthine; iodomethane Formula: C19H34IN5O2 MolecularWeight: 491.41003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)N(C)CCN1C=NC2=C1C(=O)N(C(=O)N2C)C.CI

Isomeric SMILES

CC(C)CCCC(C)N(C)CCN1C=NC2=C1C(=O)N(C(=O)N2C)C.CI

InChI

InChI=1S/C18H31N5O2.CH3I/c1-13(2)8-7-9-14(3)20(4)10-11-23-12-19-16-15(23)17(24)22(6)18(25)21(16)5;1-2/h12-14H,7-11H2,1-6H3;1H3