2-azanyl-5-[[3-(2-azanylethylamino)propylamino]methyl]pyrrolo[2,3-d]pyrimidine-4-thione

Systemtic Name: 2-azanyl-5-[[3-(2-azanylethylamino)propylamino]methyl]pyrrolo[2,3-d]pyrimidine-4-thione Openeye Name: 2-amino-5-[[3-(2-aminoethylamino)propylamino]methyl]pyrrolo[2,3-d]pyrimidine-4-thione CAS Name: 2-amino-5-[[3-(2-aminoethylamino)propylamino]methyl]-4-pyrrolo[2,3-d]pyrimidinethione IUPAC Name: 2-amino-5-[[3-(2-aminoethylamino)propylamino]methyl]pyrrolo[2,3-d]pyrimidine-4-thione Traditional Name: 2-amino-5-[[3-(2-aminoethylamino)propylamino]methyl]pyrrolo[2,3-d]pyrimidine-4-thione Formula: C12H19N7S MolecularWeight: 293.39116

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=NC(=NC(=S)C2=C1CNCCCNCCN)N

Isomeric SMILES

C1=NC2=NC(=NC(=S)C2=C1CNCCCNCCN)N

InChI

InChI=1S/C12H19N7S/c13-2-5-15-3-1-4-16-6-8-7-17-10-9(8)11(20)19-12(14)18-10/h7,15-16H,1-6,13H2,(H2,14,19,20)