methyl 2,5-dimethyl-4-oxidanylidene-3-(phenylmethyl)-7,8-dihydroimidazo[2,1-b]purine-7-carboxylate

Systemtic Name: methyl 2,5-dimethyl-4-oxidanylidene-3-(phenylmethyl)-7,8-dihydroimidazo[2,1-b]purine-7-carboxylate Openeye Name: methyl 3-benzyl-2,5-dimethyl-4-oxo-7,8-dihydroimidazo[2,1-b]purine-7-carboxylate CAS Name: 2,5-dimethyl-4-oxo-3-(phenylmethyl)-7,8-dihydroimidazo[2,1-b]purine-7-carboxylic acid methyl ester IUPAC Name: methyl 3-benzyl-2,5-dimethyl-4-oxo-7,8-dihydroimidazo[2,1-b]purine-7-carboxylate Traditional Name: 3-benzyl-4-keto-2,5-dimethyl-7,8-dihydroimidazo[2,1-b]purine-7-carboxylic acid methyl ester Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=CC=CC=C3)C(=O)N(C4=NC(CN24)C(=O)OC)C

Isomeric SMILES

CC1=NC2=C(N1CC3=CC=CC=C3)C(=O)N(C4=NC(CN24)C(=O)OC)C

InChI

InChI=1S/C18H19N5O3/c1-11-19-15-14(22(11)9-12-7-5-4-6-8-12)16(24)21(2)18-20-13(10-23(15)18)17(25)26-3/h4-8,13H,9-10H2,1-3H3