2-butyl-9-(2-ethoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 2-butyl-9-(2-ethoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 2-butyl-9-(2-ethoxyphenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 2-butyl-9-(2-ethoxyphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 2-butyl-9-(2-ethoxyphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 2-butyl-8-keto-9-o-phenetyl-7H-purine-6-carboxamide Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C2C(=N1)N(C(=O)N2)C3=CC=CC=C3OCC)C(=O)N

Isomeric SMILES

CCCCC1=NC(=C2C(=N1)N(C(=O)N2)C3=CC=CC=C3OCC)C(=O)N

InChI

InChI=1S/C18H21N5O3/c1-3-5-10-13-20-14(16(19)24)15-17(21-13)23(18(25)22-15)11-8-6-7-9-12(11)26-4-2/h6-9H,3-5,10H2,1-2H3,(H2,19,24)(H,22,25)