3-cyclohexyl-5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-3-ium-4-amine

Systemtic Name: 3-cyclohexyl-5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-3-ium-4-amine Openeye Name: 3-cyclohexyl-5,6-dimethyl-7-(3-morpholinopropyl)pyrrolo[2,3-d]pyrimidin-3-ium-4-amine CAS Name: 3-cyclohexyl-5,6-dimethyl-7-[3-(4-morpholinyl)propyl]-4-pyrrolo[2,3-d]pyrimidin-3-iumamine IUPAC Name: 3-cyclohexyl-5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-3-ium-4-amine Traditional Name: [3-cyclohexyl-5,6-dimethyl-7-(3-morpholinopropyl)pyrrolo[2,3-d]pyrimidin-3-ium-4-yl]amine Formula: C21H34N5O+ MolecularWeight: 372.52756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C(=[N+](C=N2)C3CCCCC3)N)CCCN4CCOCC4)C

Isomeric SMILES

CC1=C(N(C2=C1C(=[N+](C=N2)C3CCCCC3)N)CCCN4CCOCC4)C

InChI

InChI=1S/C21H33N5O/c1-16-17(2)25(10-6-9-24-11-13-27-14-12-24)21-19(16)20(22)26(15-23-21)18-7-4-3-5-8-18/h15,18,22H,3-14H2,1-2H3/p+1