3,7-bis(2-dimethylaminoethyl)-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-3-ium-4-amine

Systemtic Name: 3,7-bis(2-dimethylaminoethyl)-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-3-ium-4-amine Openeye Name: 3,7-bis(2-dimethylaminoethyl)-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-3-ium-4-amine CAS Name: 3,7-bis(2-dimethylaminoethyl)-5,6-dimethyl-4-pyrrolo[2,3-d]pyrimidin-3-iumamine IUPAC Name: 3,7-bis(2-dimethylaminoethyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-3-ium-4-amine Traditional Name: 2-[4-amino-3-(2-dimethylaminoethyl)-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-3-ium-7-yl]ethyl-dimethyl-amine Formula: C16H29N6+ MolecularWeight: 305.44166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N6/c1-12-13(2)22(10-8-20(5)6)16-14(12)15(17)21(11-18-16)9-7-19(3)4/h11,17H,7-10H2,1-6H3/p+1