2-[[3-[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]-4-ethoxy-phenyl]sulfonylamino]ethanamide

Systemtic Name: 2-[[3-[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]-4-ethoxy-phenyl]sulfonylamino]ethanamide Openeye Name: 2-[[3-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)-4-ethoxy-phenyl]sulfonylamino]acetamide CAS Name: 2-[[3-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)-4-ethoxyphenyl]sulfonylamino]acetamide IUPAC Name: 2-[[3-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)-4-ethoxyphenyl]sulfonylamino]acetamide Traditional Name: 2-[[3-(2,6-diketo-1,3-dimethyl-7H-purin-8-yl)-4-ethoxy-phenyl]sulfonylamino]acetamide Formula: C17H20N6O6S MolecularWeight: 436.4423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)N)C2=NC3=C(N2)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)N)C2=NC3=C(N2)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C17H20N6O6S/c1-4-29-11-6-5-9(30(27,28)19-8-12(18)24)7-10(11)14-20-13-15(21-14)22(2)17(26)23(3)16(13)25/h5-7,19H,4,8H2,1-3H3,(H2,18,24)(H,20,21)