2-(1H-indol-3-yl)-8-oxidanylidene-9-thiophen-2-yl-7H-purine-6-carboxamide

Systemtic Name: 2-(1H-indol-3-yl)-8-oxidanylidene-9-thiophen-2-yl-7H-purine-6-carboxamide Openeye Name: 2-(1H-indol-3-yl)-8-oxo-9-(2-thienyl)-7H-purine-6-carboxamide CAS Name: 2-(1H-indol-3-yl)-8-oxo-9-thiophen-2-yl-7H-purine-6-carboxamide IUPAC Name: 2-(1H-indol-3-yl)-8-oxo-9-thiophen-2-yl-7H-purine-6-carboxamide Traditional Name: 2-(1H-indol-3-yl)-8-keto-9-(2-thienyl)-7H-purine-6-carboxamide Formula: C18H12N6O2S MolecularWeight: 376.39188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C3=NC(=C4C(=N3)N(C(=O)N4)C5=CC=CS5)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C3=NC(=C4C(=N3)N(C(=O)N4)C5=CC=CS5)C(=O)N

InChI

InChI=1S/C18H12N6O2S/c19-15(25)13-14-17(24(18(26)22-14)12-6-3-7-27-12)23-16(21-13)10-8-20-11-5-2-1-4-9(10)11/h1-8,20H,(H2,19,25)(H,22,26)