2-(2-nitrophenyl)-8-oxidanylidene-9-thiophen-2-yl-7H-purine-6-carboxamide

Systemtic Name: 2-(2-nitrophenyl)-8-oxidanylidene-9-thiophen-2-yl-7H-purine-6-carboxamide Openeye Name: 2-(2-nitrophenyl)-8-oxo-9-(2-thienyl)-7H-purine-6-carboxamide CAS Name: 2-(2-nitrophenyl)-8-oxo-9-thiophen-2-yl-7H-purine-6-carboxamide IUPAC Name: 2-(2-nitrophenyl)-8-oxo-9-thiophen-2-yl-7H-purine-6-carboxamide Traditional Name: 8-keto-2-(2-nitrophenyl)-9-(2-thienyl)-7H-purine-6-carboxamide Formula: C16H10N6O4S MolecularWeight: 382.3534

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC=CS4)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC=CS4)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H10N6O4S/c17-13(23)11-12-15(21(16(24)19-12)10-6-3-7-27-10)20-14(18-11)8-4-1-2-5-9(8)22(25)26/h1-7H,(H2,17,23)(H,19,24)