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

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

Systemtic Name:9-[4-(dimethylamino)butyl]-2-phenylazanyl-3H-purin-6-one dihydrochloride
Openeye Name:2-anilino-9-[4-(dimethylamino)butyl]-3H-purin-6-one dihydrochloride
CAS Name:2-anilino-9-[4-(dimethylamino)butyl]-3H-purin-6-one dihydrochloride
IUPAC Name:2-anilino-9-[4-(dimethylamino)butyl]-3H-purin-6-one dihydrochloride
Traditional Name:2-anilino-9-[4-(dimethylamino)butyl]-3H-purin-6-one dihydrochloride
Formula: C17H24Cl2N6O
MolecularWeight: 399.31806
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C17H22N6O.2ClH/c1-22(2)10-6-7-11-23-12-18-14-15(23)20-17(21-16(14)24)19-13-8-4-3-5-9-13;;/h3-5,8-9,12H,6-7,10-11H2,1-2H3,(H2,19,20,21,24);2*1H


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