2-[[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]sulfanyl]ethanal

Systemtic Name: 2-[[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]sulfanyl]ethanal Openeye Name: 2-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)sulfanyl]acetaldehyde CAS Name: 2-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)thio]acetaldehyde IUPAC Name: 2-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)sulfanyl]acetaldehyde Traditional Name: 2-[(2,6-diketo-1,3-dimethyl-7H-purin-8-yl)thio]acetaldehyde Formula: C9H10N4O3S MolecularWeight: 254.2657

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)SCC=O

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)SCC=O

InChI

InChI=1S/C9H10N4O3S/c1-12-6-5(7(15)13(2)9(12)16)10-8(11-6)17-4-3-14/h3H,4H2,1-2H3,(H,10,11)