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9-[4-(diethylamino)butyl]-2-phenylazanyl-3H-purin-6-one dihydrochloride

9-[4-(diethylamino)butyl]-2-phenylazanyl-3H-purin-6-one dihydrochloride

Systemtic Name:9-[4-(diethylamino)butyl]-2-phenylazanyl-3H-purin-6-one dihydrochloride
Openeye Name:2-anilino-9-[4-(diethylamino)butyl]-3H-purin-6-one dihydrochloride
CAS Name:2-anilino-9-[4-(diethylamino)butyl]-3H-purin-6-one dihydrochloride
IUPAC Name:2-anilino-9-[4-(diethylamino)butyl]-3H-purin-6-one dihydrochloride
Traditional Name:2-anilino-9-[4-(diethylamino)butyl]-3H-purin-6-one dihydrochloride
Formula: C19H28Cl2N6O
MolecularWeight: 427.37122
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCCN1C=NC2=C1NC(=NC2=O)NC3=CC=CC=C3.Cl.Cl


Isomeric SMILES

CCN(CC)CCCCN1C=NC2=C1NC(=NC2=O)NC3=CC=CC=C3.Cl.Cl


InChI

InChI=1S/C19H26N6O.2ClH/c1-3-24(4-2)12-8-9-13-25-14-20-16-17(25)22-19(23-18(16)26)21-15-10-6-5-7-11-15;;/h5-7,10-11,14H,3-4,8-9,12-13H2,1-2H3,(H2,21,22,23,26);2*1H


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