8-oxidanylidene-2-propan-2-yl-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide

Systemtic Name: 8-oxidanylidene-2-propan-2-yl-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide Openeye Name: 2-isopropyl-8-oxo-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide CAS Name: 8-oxo-2-propan-2-yl-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide IUPAC Name: 8-oxo-2-propan-2-yl-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide Traditional Name: 2-isopropyl-8-keto-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide Formula: C18H21N5O5 MolecularWeight: 387.38984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=C2C(=N1)N(C(=O)N2)C3=CC(=C(C(=C3)OC)OC)OC)C(=O)N

Isomeric SMILES

CC(C)C1=NC(=C2C(=N1)N(C(=O)N2)C3=CC(=C(C(=C3)OC)OC)OC)C(=O)N

InChI

InChI=1S/C18H21N5O5/c1-8(2)16-20-12(15(19)24)13-17(22-16)23(18(25)21-13)9-6-10(26-3)14(28-5)11(7-9)27-4/h6-8H,1-5H3,(H2,19,24)(H,21,25)