2-[[2-acetamido-6,8-bis(sulfanylidene)-3,7-dihydropurin-9-yl]methoxy]ethyl ethanoate

Systemtic Name: 2-[[2-acetamido-6,8-bis(sulfanylidene)-3,7-dihydropurin-9-yl]methoxy]ethyl ethanoate Openeye Name: 2-[(2-acetamido-6,8-dithioxo-3,7-dihydropurin-9-yl)methoxy]ethyl acetate CAS Name: acetic acid 2-[[2-acetamido-6,8-bis(sulfanylidene)-3,7-dihydropurin-9-yl]methoxy]ethyl ester IUPAC Name: 2-[[2-acetamido-6,8-bis(sulfanylidene)-3,7-dihydropurin-9-yl]methoxy]ethyl acetate Traditional Name: acetic acid 2-[(2-acetamido-6,8-dithioxo-3,7-dihydropurin-9-yl)methoxy]ethyl ester Formula: C12H15N5O4S2 MolecularWeight: 357.4086

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=S)C2=C(N1)N(C(=S)N2)COCCOC(=O)C

Isomeric SMILES

CC(=O)NC1=NC(=S)C2=C(N1)N(C(=S)N2)COCCOC(=O)C

InChI

InChI=1S/C12H15N5O4S2/c1-6(18)13-11-15-9-8(10(22)16-11)14-12(23)17(9)5-20-3-4-21-7(2)19/h3-5H2,1-2H3,(H,14,23)(H2,13,15,16,18,22)