N-[1,1-bis(oxidanylidene)thian-4-yl]-7H-purin-6-amine

Systemtic Name: N-[1,1-bis(oxidanylidene)thian-4-yl]-7H-purin-6-amine Openeye Name: N-(1,1-dioxothian-4-yl)-7H-purin-6-amine CAS Name: N-(1,1-dioxo-4-thianyl)-7H-purin-6-amine IUPAC Name: N-(1,1-dioxothian-4-yl)-7H-purin-6-amine Traditional Name: (1,1-diketothian-4-yl)-(7H-purin-6-yl)amine Formula: C10H13N5O2S MolecularWeight: 267.30752

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NC2=NC=NC3=C2NC=N3

Isomeric SMILES

C1CS(=O)(=O)CCC1NC2=NC=NC3=C2NC=N3

InChI

InChI=1S/C10H13N5O2S/c16-18(17)3-1-7(2-4-18)15-10-8-9(12-5-11-8)13-6-14-10/h5-7H,1-4H2,(H2,11,12,13,14,15)