N,N-bis(2-methoxyethyl)-2-methyl-8-phenyl-9-[1-(phenylmethyl)pyrrolidin-3-yl]purin-6-amine

Systemtic Name: N,N-bis(2-methoxyethyl)-2-methyl-8-phenyl-9-[1-(phenylmethyl)pyrrolidin-3-yl]purin-6-amine Openeye Name: 9-(1-benzylpyrrolidin-3-yl)-N,N-bis(2-methoxyethyl)-2-methyl-8-phenyl-purin-6-amine CAS Name: N,N-bis(2-methoxyethyl)-2-methyl-8-phenyl-9-[1-(phenylmethyl)-3-pyrrolidinyl]-6-purinamine IUPAC Name: 9-(1-benzylpyrrolidin-3-yl)-N,N-bis(2-methoxyethyl)-2-methyl-8-phenylpurin-6-amine Traditional Name: [9-(1-benzylpyrrolidin-3-yl)-2-methyl-8-phenyl-purin-6-yl]-bis(2-methoxyethyl)amine Formula: C29H36N6O2 MolecularWeight: 500.63514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)N(CCOC)CCOC)N=C(N2C3CCN(C3)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=C(C(=N1)N(CCOC)CCOC)N=C(N2C3CCN(C3)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H36N6O2/c1-22-30-28(34(16-18-36-2)17-19-37-3)26-29(31-22)35(27(32-26)24-12-8-5-9-13-24)25-14-15-33(21-25)20-23-10-6-4-7-11-23/h4-13,25H,14-21H2,1-3H3