7-(4-methoxyphenyl)-5,6-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 7-(4-methoxyphenyl)-5,6-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 7-(4-methoxyphenyl)-5,6-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 7-(4-methoxyphenyl)-5,6-dimethyl-N-[2-(4-morpholin-4-iumyl)ethyl]-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 7-(4-methoxyphenyl)-5,6-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [7-(4-methoxyphenyl)-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-4-yl]-(2-morpholin-4-ium-4-ylethyl)amine Formula: C21H28N5O2+ MolecularWeight: 382.47932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C(=NC=N2)NCC[NH+]3CCOCC3)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=C(N(C2=C1C(=NC=N2)NCC[NH+]3CCOCC3)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C21H27N5O2/c1-15-16(2)26(17-4-6-18(27-3)7-5-17)21-19(15)20(23-14-24-21)22-8-9-25-10-12-28-13-11-25/h4-7,14H,8-13H2,1-3H3,(H,22,23,24)/p+1