N-(4-oxidanylidene-2-sulfanylidene-1H-benzo[g]pteridin-8-yl)propanamide

Systemtic Name: N-(4-oxidanylidene-2-sulfanylidene-1H-benzo[g]pteridin-8-yl)propanamide Openeye Name: N-(4-oxo-2-thioxo-1H-benzo[g]pteridin-8-yl)propanamide CAS Name: N-(4-oxo-2-sulfanylidene-1H-benzo[g]pteridin-8-yl)propanamide IUPAC Name: N-(4-oxo-2-sulfanylidene-1H-benzo[g]pteridin-8-yl)propanamide Traditional Name: N-(4-keto-2-thioxo-1H-benzo[g]pteridin-8-yl)propionamide Formula: C13H11N5O2S MolecularWeight: 301.32374

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC2=C(C=C1)N=C3C(=N2)NC(=S)NC3=O

Isomeric SMILES

CCC(=O)NC1=CC2=C(C=C1)N=C3C(=N2)NC(=S)NC3=O

InChI

InChI=1S/C13H11N5O2S/c1-2-9(19)14-6-3-4-7-8(5-6)16-11-10(15-7)12(20)18-13(21)17-11/h3-5H,2H2,1H3,(H,14,19)(H2,16,17,18,20,21)