2-azanyl-4-[(4-chlorophenyl)methyl]-1-methyl-6,7-dihydroimidazo[1,2-a]purin-9-one hydrate

Systemtic Name: 2-azanyl-4-[(4-chlorophenyl)methyl]-1-methyl-6,7-dihydroimidazo[1,2-a]purin-9-one hydrate Openeye Name: 2-amino-4-[(4-chlorophenyl)methyl]-1-methyl-6,7-dihydroimidazo[1,2-a]purin-9-one hydrate CAS Name: 2-amino-4-[(4-chlorophenyl)methyl]-1-methyl-6,7-dihydroimidazo[1,2-a]purin-9-one hydrate IUPAC Name: 2-amino-4-[(4-chlorophenyl)methyl]-1-methyl-6,7-dihydroimidazo[1,2-a]purin-9-one hydrate Traditional Name: 2-amino-4-(4-chlorobenzyl)-1-methyl-6,7-dihydroimidazo[1,2-a]purin-9-one hydrate Formula: C15H17ClN6O2 MolecularWeight: 348.78748

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1N)N(C3=NCCN3C2=O)CC4=CC=C(C=C4)Cl.O

Isomeric SMILES

CN1C2=C(N=C1N)N(C3=NCCN3C2=O)CC4=CC=C(C=C4)Cl.O

InChI

InChI=1S/C15H15ClN6O.H2O/c1-20-11-12(19-14(20)17)22(8-9-2-4-10(16)5-3-9)15-18-6-7-21(15)13(11)23;/h2-5H,6-8H2,1H3,(H2,17,19);1H2