3-azanyl-2-(5-chloranyl-2-oxidanylidene-pentyl)-7-(phenylmethyl)-5-propyl-pyrazolo[3,4-d]pyrimidine-4,6-dione

Systemtic Name: 3-azanyl-2-(5-chloranyl-2-oxidanylidene-pentyl)-7-(phenylmethyl)-5-propyl-pyrazolo[3,4-d]pyrimidine-4,6-dione Openeye Name: 3-amino-7-benzyl-2-(5-chloro-2-oxo-pentyl)-5-propyl-pyrazolo[3,4-d]pyrimidine-4,6-dione CAS Name: 3-amino-2-(5-chloro-2-oxopentyl)-7-(phenylmethyl)-5-propylpyrazolo[3,4-d]pyrimidine-4,6-dione IUPAC Name: 3-amino-7-benzyl-2-(5-chloro-2-oxopentyl)-5-propylpyrazolo[3,4-d]pyrimidine-4,6-dione Traditional Name: 3-amino-7-benzyl-2-(5-chloro-2-keto-pentyl)-5-propyl-pyrazolo[3,4-d]pyrimidine-4,6-quinone Formula: C20H24ClN5O3 MolecularWeight: 417.88926

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N(N=C2N(C1=O)CC3=CC=CC=C3)CC(=O)CCCCl)N

Isomeric SMILES

CCCN1C(=O)C2=C(N(N=C2N(C1=O)CC3=CC=CC=C3)CC(=O)CCCCl)N

InChI

InChI=1S/C20H24ClN5O3/c1-2-11-24-19(28)16-17(22)26(13-15(27)9-6-10-21)23-18(16)25(20(24)29)12-14-7-4-3-5-8-14/h3-5,7-8H,2,6,9-13,22H2,1H3