2-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-8-oxidanylidene-9-thiophen-2-yl-1,7-dihydropurine-6-carboxamide

Systemtic Name: 2-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-8-oxidanylidene-9-thiophen-2-yl-1,7-dihydropurine-6-carboxamide Openeye Name: 2-(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-8-oxo-9-(2-thienyl)-1,7-dihydropurine-6-carboxamide CAS Name: 2-(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-8-oxo-9-thiophen-2-yl-1,7-dihydropurine-6-carboxamide IUPAC Name: 2-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-8-oxo-9-thiophen-2-yl-1,7-dihydropurine-6-carboxamide Traditional Name: 8-keto-2-(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)-9-(2-thienyl)-1,7-dihydropurine-6-carboxamide Formula: C17H13N5O4S MolecularWeight: 383.38122

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2NC(=C3C(=N2)N(C(=O)N3)C4=CC=CS4)C(=O)N)C=CC1=O

Isomeric SMILES

COC1=CC(=C2NC(=C3C(=N2)N(C(=O)N3)C4=CC=CS4)C(=O)N)C=CC1=O

InChI

InChI=1S/C17H13N5O4S/c1-26-10-7-8(4-5-9(10)23)15-19-12(14(18)24)13-16(21-15)22(17(25)20-13)11-3-2-6-27-11/h2-7,19H,1H3,(H2,18,24)(H,20,25)