2-butyl-9-(3-methoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 2-butyl-9-(3-methoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 2-butyl-9-(3-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 2-butyl-9-(3-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 2-butyl-9-(3-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 2-butyl-8-keto-9-(3-methoxyphenyl)-7H-purine-6-carboxamide Formula: C17H19N5O3 MolecularWeight: 341.36446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N5O3/c1-3-4-8-12-19-13(15(18)23)14-16(20-12)22(17(24)21-14)10-6-5-7-11(9-10)25-2/h5-7,9H,3-4,8H2,1-2H3,(H2,18,23)(H,21,24)