5-butyl-7-(2-chloroethyl)-3-(methylamino)-2H-pyrazolo[3,4-d]pyrimidine-4,6-dione

Systemtic Name: 5-butyl-7-(2-chloroethyl)-3-(methylamino)-2H-pyrazolo[3,4-d]pyrimidine-4,6-dione Openeye Name: 5-butyl-7-(2-chloroethyl)-3-(methylamino)-2H-pyrazolo[3,4-d]pyrimidine-4,6-dione CAS Name: 5-butyl-7-(2-chloroethyl)-3-(methylamino)-2H-pyrazolo[3,4-d]pyrimidine-4,6-dione IUPAC Name: 5-butyl-7-(2-chloroethyl)-3-(methylamino)-2H-pyrazolo[3,4-d]pyrimidine-4,6-dione Traditional Name: 5-butyl-7-(2-chloroethyl)-3-(methylamino)-2H-pyrazolo[3,4-d]pyrimidine-4,6-quinone Formula: C12H18ClN5O2 MolecularWeight: 299.75662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(NN=C2N(C1=O)CCCl)NC

Isomeric SMILES

CCCCN1C(=O)C2=C(NN=C2N(C1=O)CCCl)NC

InChI

InChI=1S/C12H18ClN5O2/c1-3-4-6-18-11(19)8-9(14-2)15-16-10(8)17(7-5-13)12(18)20/h3-7H2,1-2H3,(H2,14,15,16)