2-(4-ethoxy-3-methoxy-phenyl)-8-oxidanylidene-9-thiophen-2-yl-7H-purine-6-carboxamide

Systemtic Name: 2-(4-ethoxy-3-methoxy-phenyl)-8-oxidanylidene-9-thiophen-2-yl-7H-purine-6-carboxamide Openeye Name: 2-(4-ethoxy-3-methoxy-phenyl)-8-oxo-9-(2-thienyl)-7H-purine-6-carboxamide CAS Name: 2-(4-ethoxy-3-methoxyphenyl)-8-oxo-9-thiophen-2-yl-7H-purine-6-carboxamide IUPAC Name: 2-(4-ethoxy-3-methoxyphenyl)-8-oxo-9-thiophen-2-yl-7H-purine-6-carboxamide Traditional Name: 2-(4-ethoxy-3-methoxy-phenyl)-8-keto-9-(2-thienyl)-7H-purine-6-carboxamide Formula: C19H17N5O4S MolecularWeight: 411.43438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC=CS4)C(=O)N)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC=CS4)C(=O)N)OC

InChI

InChI=1S/C19H17N5O4S/c1-3-28-11-7-6-10(9-12(11)27-2)17-21-14(16(20)25)15-18(23-17)24(19(26)22-15)13-5-4-8-29-13/h4-9H,3H2,1-2H3,(H2,20,25)(H,22,26)